data_2k8e_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 2k8e _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 ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.738 0 N-CA-C 113.265 0.066 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.1 p90 -160.03 150.13 18.39 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.195 0.522 . . . . 0.0 111.027 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -94.32 149.35 21.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.178 0.991 . . . . 0.0 108.598 170.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.548 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.6 mt-10 -131.37 109.5 10.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 171.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.5 tp -87.16 107.98 18.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.5 t -122.62 142.96 50.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.935 0.894 . . . . 0.0 109.045 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -94.7 139.65 30.95 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 171.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.0 m -76.38 -175.54 3.29 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 0.0 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.6 t -61.16 -25.78 67.25 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.062 0.545 . . . . 0.0 111.181 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -95.63 16.16 18.01 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.053 0.941 . . . . 0.0 110.787 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 64.06 17.62 10.73 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.261 1.424 . . . . 0.0 112.992 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.466 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 86.5 mm-40 -82.5 127.49 33.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.529 0.731 . . . . 0.0 110.724 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -85.89 122.11 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.836 0.854 . . . . 0.0 109.076 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -147.39 120.39 8.79 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 124.171 0.989 . . . . 0.0 108.556 -172.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -99.18 137.9 37.04 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.3 m -107.53 131.72 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.6 tp -91.36 123.49 34.82 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -115.7 149.76 37.89 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 109.172 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.54 -173.75 4.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.313 1.045 . . . . 0.0 110.275 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -57.34 -34.6 68.38 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 114.509 0.564 . . . . 0.0 114.509 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -88.66 8.1 30.26 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.623 0.769 . . . . 0.0 112.005 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 6.43 89.3 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.797 -0.183 . . . . 0.0 113.302 -176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.85 110.06 4.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 110.424 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -65.08 121.37 14.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 pt -114.38 -20.78 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.61 1.164 . . . . 0.0 110.897 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -147.81 146.52 29.17 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.9 m -145.78 118.12 8.44 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.745 0.818 . . . . 0.0 108.936 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 98.1 p -69.21 170.19 10.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.748 0.419 . . . . 0.0 110.871 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.84 175.15 10.32 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 121.358 0.599 . . . . 0.0 110.895 174.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 89.0 mt -75.67 113.03 12.65 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.86 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.533 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 66.6 m-85 -100.97 133.61 45.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.685 0.794 . . . . 0.0 109.319 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.3 m -68.34 -25.56 65.16 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.155 0.582 . . . . 0.0 111.059 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -130.05 147.09 51.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.474 0.71 . . . . 0.0 110.981 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -27.8 68.77 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.781 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.8 p -57.63 -36.69 72.15 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.815 0.846 . . . . 0.0 111.782 175.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.533 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 13.2 m -69.8 -33.03 71.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.605 0.762 . . . . 0.0 110.752 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.67 59.89 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.531 0.732 . . . . 0.0 111.503 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -69.39 -45.26 69.72 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.288 0.635 . . . . 0.0 109.759 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -71.29 -24.72 62.2 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.81 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.405 ' O ' HG12 ' A' ' 62' ' ' VAL . . . -64.14 -51.13 55.64 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.531 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.8 tt -71.39 -34.29 53.06 Favored 'Isoleucine or valine' 0 C--N 1.357 0.911 0 CA-C-N 116.641 0.221 . . . . 0.0 111.02 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.72 86.25 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.245 0.545 . . . . 0.0 110.275 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.6 m -74.17 -43.67 56.41 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.365 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.531 HG21 ' HA ' ' A' ' 59' ' ' ILE . 13.2 m -65.05 -29.23 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-N 119.046 0.839 . . . . 0.0 111.036 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -76.02 -35.44 59.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.041 0.536 . . . . 0.0 110.277 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -77.83 -31.77 51.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.462 0.705 . . . . 0.0 110.844 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -101.92 12.13 37.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.752 0.821 . . . . 0.0 110.9 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.9 t -64.35 -48.93 74.68 Favored Pre-proline 0 CA--C 1.559 1.325 0 C-N-CA 123.919 0.888 . . . . 0.0 111.285 174.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -78.99 -9.52 15.47 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 121.744 1.629 . . . . 0.0 112.733 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -84.92 81.22 8.99 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -59.68 -28.09 66.98 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.377 1.071 . . . . 0.0 112.256 -177.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -78.54 -23.88 45.97 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.432 ' NE ' ' HB2' ' A' ' 87' ' ' LYS . 6.5 tpm_? -75.5 -21.9 57.62 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 111.435 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -70.48 133.51 46.88 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 169.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.488 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 43.5 mm-40 -96.18 97.11 9.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.412 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -78.31 103.63 8.38 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -122.4 159.49 27.44 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.872 1.269 . . . . 0.0 110.056 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.5 m -128.26 115.94 19.09 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.443 0.697 . . . . 0.0 109.732 174.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.18 156.47 31.66 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.802 0.841 . . . . 0.0 111.342 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.4 m -67.08 -10.8 53.82 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 124.028 0.931 . . . . 0.0 111.811 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.86 4.9 17.66 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 123.902 0.881 . . . . 0.0 110.083 172.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 34.13 67.87 Favored Glycine 0 C--N 1.352 1.434 0 C-N-CA 123.206 0.432 . . . . 0.0 112.731 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.6 mmtt -114.32 124.52 52.2 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.188 0.595 . . . . 0.0 110.211 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.489 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 77.4 m-85 -91.78 125.79 36.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.308 0.643 . . . . 0.0 109.876 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.625 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 25.3 p90 -146.66 174.75 11.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.244 1.018 . . . . 0.0 108.921 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.488 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 44.9 p90 -145.0 135.49 24.29 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.786 0.326 . . . . 0.0 111.345 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.523 ' HB3' HD12 ' A' ' 93' ' ' ILE . 6.1 m-20 -112.48 114.88 27.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.589 0.756 . . . . 0.0 109.328 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 41.5 tp -80.23 119.06 22.48 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.432 ' HB2' ' NE ' ' A' ' 71' ' ' ARG . 34.0 mmtp -87.11 156.85 19.55 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.009 0.924 . . . . 0.0 111.27 -177.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.6 175.14 5.6 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.227 167.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.39 -28.25 69.86 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.525 0.678 . . . . 0.0 110.63 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -81.91 10.81 5.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.456 1.103 . . . . 0.0 112.153 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 66.59 4.89 3.54 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.78 1.232 . . . . 0.0 111.983 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -85.38 140.83 30.45 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.771 0.828 . . . . 0.0 110.427 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.523 HD12 ' HB3' ' A' ' 85' ' ' ASN . 20.5 mm -76.14 99.67 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 14.2 pt -79.44 -11.37 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.019 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.38 108.2 0.26 Allowed Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.3 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.425 ' HB3' HG21 ' A' ' 93' ' ' ILE . 77.8 p -92.01 134.54 34.72 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -88.39 160.32 17.63 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.169 0.509 . . . . 0.0 109.855 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.82 141.42 48.01 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.865 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.625 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.1 ptt? -73.47 116.51 14.13 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.413 0.625 . . . . 0.0 109.645 -176.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -93.35 158.32 15.8 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.252 -176.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 -54.68 7.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 122.567 0.347 . . . . 0.0 110.453 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 p -97.36 155.85 16.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.371 0.668 . . . . 0.0 111.782 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -70.49 -33.54 71.34 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.641 0.777 . . . . 0.0 110.895 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -63.08 -32.19 73.51 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.004 0.522 . . . . 0.0 111.292 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -71.48 -30.1 65.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.432 0.693 . . . . 0.0 110.662 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 57.5 ttp180 -69.77 -38.73 76.85 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.319 0.648 . . . . 0.0 109.949 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 22.3 mm-40 -71.14 -40.08 71.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.244 0.618 . . . . 0.0 110.986 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.4 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.466 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.94 -44.63 97.56 Favored Glycine 0 C--N 1.347 1.18 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.471 174.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.93 -46.44 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.435 0.694 . . . . 0.0 109.961 176.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.48 80.23 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.923 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.5 t -76.0 -44.15 40.89 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.993 0.517 . . . . 0.0 110.451 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 87.5 t -68.57 -27.78 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.004 0.522 . . . . 0.0 110.229 177.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -69.89 -37.83 76.16 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.002 0.521 . . . . 0.0 110.706 173.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.22 -51.06 16.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.448 0.699 . . . . 0.0 111.74 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -89.28 -13.95 36.92 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 111.14 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.81 -20.71 70.23 Favored Glycine 0 C--N 1.349 1.255 0 CA-C-N 116.473 -0.33 . . . . 0.0 113.164 178.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.6 p -72.19 -10.87 60.36 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.915 0.486 . . . . 0.0 111.263 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.7 t -84.02 172.91 11.59 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.681 0.792 . . . . 0.0 110.179 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -148.29 24.94 1.01 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.782 0.833 . . . . 0.0 109.064 175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -73.94 83.0 1.71 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.589 0.756 . . . . 0.0 110.794 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 47.1 t -89.53 120.63 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.722 0.809 . . . . 0.0 110.617 -176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.548 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 68.3 mttm -93.04 113.54 25.83 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.392 1.077 . . . . 0.0 108.708 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.13 96.1 2.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.766 0.794 . . . . 0.0 109.938 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -92.27 -7.77 47.14 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.849 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.478 0.957 0 C-N-CA 124.373 1.069 . . . . 0.0 111.178 172.451 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.317 0 CA-C-O 120.933 0.185 . . . . 0.0 113.176 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -140.1 158.38 44.15 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.877 1.271 . . . . 0.0 109.526 -176.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.453 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 66.2 m-85 -98.85 146.94 25.43 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.636 0.775 . . . . 0.0 109.43 173.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -133.55 111.57 10.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.619 0.768 . . . . 0.0 109.122 174.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -80.3 95.94 6.49 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 173.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -104.27 -177.38 3.35 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.003 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.499 ' HE3' ' HA ' ' A' ' 29' ' ' ASN . 22.0 ptmt -135.01 146.45 49.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.136 0.574 . . . . 0.0 109.657 174.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.4 m -78.12 169.72 17.8 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.54 0.736 . . . . 0.0 110.344 170.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.52 -10.98 59.12 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.101 0.56 . . . . 0.0 111.177 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -86.87 8.58 22.36 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.059 0.943 . . . . 0.0 111.569 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.499 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 42.3 m-80 69.46 7.94 6.5 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.482 1.513 . . . . 0.0 112.88 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.455 ' HB2' HD13 ' A' ' 48' ' ' LEU . 11.6 mm-40 -84.74 137.59 33.12 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.001 0.52 . . . . 0.0 110.086 -178.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -91.72 134.05 35.06 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.978 0.911 . . . . 0.0 109.854 -172.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -152.87 141.26 20.65 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.625 0.77 . . . . 0.0 108.967 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -98.59 141.06 31.91 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.522 HG12 HG21 ' A' ' 45' ' ' THR . 28.8 m -113.04 133.37 59.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 172.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.5 OUTLIER -88.0 108.04 19.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 167.645 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.546 ' HZ3' ' HB2' ' A' ' 36' ' ' LYS . 4.3 ttmp? -111.54 114.86 28.22 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.155 0.982 . . . . 0.0 109.657 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.42 173.21 2.17 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.173 0.989 . . . . 0.0 112.602 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.15 -15.91 61.47 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.511 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -74.83 -6.06 46.95 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.059 0.944 . . . . 0.0 111.671 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.74 14.94 80.34 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -117.36 137.45 52.45 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.049 0.94 . . . . 0.0 109.97 -177.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 60.8 m -76.82 121.64 23.66 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.364 0.666 . . . . 0.0 110.401 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.5 pt -89.49 -19.84 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.008 0.923 . . . . 0.0 110.843 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 tp -159.89 118.37 2.73 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -172.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.522 HG21 HG12 ' A' ' 34' ' ' VAL . 55.4 m -111.31 127.35 55.61 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.457 0.703 . . . . 0.0 109.377 175.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.9 t -81.56 170.2 16.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.603 0.361 . . . . 0.0 111.13 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -83.22 -175.77 5.99 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.455 HD13 ' HB2' ' A' ' 30' ' ' GLN . 2.5 mm? -85.5 113.62 21.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.753 -172.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.429 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 75.8 m-85 -107.26 119.58 39.8 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.825 0.85 . . . . 0.0 108.721 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 81.4 p -61.71 -33.48 74.1 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.561 0.744 . . . . 0.0 111.644 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -113.75 135.8 53.55 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.095 0.958 . . . . 0.0 109.092 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.32 -28.15 67.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.452 0.701 . . . . 0.0 111.126 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.8 p -57.39 -36.21 70.98 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.074 0.95 . . . . 0.0 111.698 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.429 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 24.9 m -71.45 -28.85 64.25 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.252 0.621 . . . . 0.0 111.407 177.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.56 -32.11 57.96 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.608 0.763 . . . . 0.0 111.29 173.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -73.4 -34.07 65.32 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.597 0.759 . . . . 0.0 110.577 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -78.09 -26.34 48.06 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.701 170.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.39 -41.91 94.19 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.361 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.509 ' HA ' HG21 ' A' ' 62' ' ' VAL . 11.0 tt -71.99 -32.41 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 175.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.22 -32.91 74.42 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.752 0.421 . . . . 0.0 110.738 172.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.2 m -69.3 -53.74 18.18 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.381 176.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.509 HG21 ' HA ' ' A' ' 59' ' ' ILE . 16.4 m -63.9 -29.1 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 123.047 0.217 . . . . 0.0 111.269 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -55.85 17.6 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.827 0.851 . . . . 0.0 108.728 178.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.9 t -66.52 -23.6 66.26 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.333 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.19 4.7 46.84 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.962 0.905 . . . . 0.0 112.28 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.1 m -66.76 -48.12 53.51 Favored Pre-proline 0 CA--C 1.565 1.531 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.254 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.95 -16.1 23.23 Favored 'Trans proline' 0 C--N 1.398 3.134 0 C-N-CA 121.814 1.676 . . . . 0.0 112.728 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -84.63 99.84 11.05 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.211 0.604 . . . . 0.0 110.394 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.67 -23.42 65.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.929 0.891 . . . . 0.0 112.535 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -73.3 -30.18 63.21 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.149 0.979 . . . . 0.0 110.615 -176.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -75.97 -12.04 60.07 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.41 0.684 . . . . 0.0 112.055 -171.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -129.17 145.77 51.24 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.579 0.351 . . . . 0.0 110.282 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 36.8 tt0 -130.7 147.24 52.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.531 0.732 . . . . 0.0 109.875 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.06 112.57 5.76 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 74.7 mmtt -111.9 142.04 44.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.666 0.787 . . . . 0.0 111.459 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 55.4 m -123.55 117.63 25.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.452 0.701 . . . . 0.0 109.352 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.04 168.4 6.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.375 1.07 . . . . 0.0 112.232 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.3 m -64.56 -24.45 67.6 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.223 1.009 . . . . 0.0 112.079 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.444 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 14.7 m120 -89.21 9.78 24.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 0.0 111.337 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.0 5.43 89.74 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 116.499 -0.318 . . . . 0.0 113.326 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.444 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 73.2 mmtt -73.36 152.56 40.82 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.473 0.709 . . . . 0.0 110.311 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.41 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 92.7 m-85 -113.27 126.73 55.73 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.303 0.641 . . . . 0.0 109.989 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.83 -179.92 8.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.066 1.346 . . . . 0.0 108.295 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -139.38 172.26 13.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.989 -0.444 . . . . 0.0 109.948 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -145.31 141.9 28.96 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.669 0.388 . . . . 0.0 110.489 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.59 140.11 31.69 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.929 0.892 . . . . 0.0 109.214 177.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -121.78 158.83 27.96 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.66 1.584 . . . . 0.0 110.247 -172.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -128.63 -176.48 3.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.831 0.852 . . . . 0.0 110.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.44 -22.02 66.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.721 0.808 . . . . 0.0 111.625 175.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -73.24 -16.72 61.4 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.522 1.129 . . . . 0.0 111.315 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 m80 67.15 14.68 9.86 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.324 1.45 . . . . 0.0 111.025 -167.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -88.36 161.76 16.93 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.493 0.717 . . . . 0.0 110.269 177.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.3 mm -84.66 104.08 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.948 -1.023 . . . . 0.0 108.352 174.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.84 -2.33 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.005 0.522 . . . . 0.0 110.471 173.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.59 146.49 8.88 Favored Glycine 0 C--N 1.341 0.851 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.3 p -156.61 123.48 5.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.173 0.989 . . . . 0.0 108.761 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.9 m -72.43 171.89 11.44 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.315 1.046 . . . . 0.0 112.649 -171.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.41 150.7 38.26 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 171.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.62 115.27 12.83 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -100.66 150.34 22.84 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.65 -31.91 52.94 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.388 0.275 . . . . 0.0 110.971 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.3 p -110.81 148.7 31.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.065 0.546 . . . . 0.0 111.778 -174.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.32 -24.4 61.3 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.421 1.089 . . . . 0.0 112.353 -175.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -68.78 -32.91 72.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.276 0.631 . . . . 0.0 111.54 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.5 m -68.76 -31.38 70.37 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.015 0.526 . . . . 0.0 112.368 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.41 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 38.6 ptt180 -75.99 -39.75 55.19 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 117.421 0.101 . . . . 0.0 110.875 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -76.91 -28.64 55.39 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -66.41 -38.4 87.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 168.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.35 -37.06 92.49 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.748 174.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.9 mm -59.39 -51.44 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.546 0.739 . . . . 0.0 109.572 174.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.79 68.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.671 0.789 . . . . 0.0 111.353 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.3 t -75.52 -33.81 60.75 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.897 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.1 t -70.45 -35.05 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 122.971 0.508 . . . . 0.0 110.235 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.463 ' HZ2' ' HB3' ' A' ' 114' ' ' LYS . 8.0 mtpm? -67.53 -34.27 76.74 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.564 0.746 . . . . 0.0 111.053 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -50.17 8.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.167 0.587 . . . . 0.0 111.294 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -89.22 -1.77 58.21 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.695 0.798 . . . . 0.0 112.208 -170.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.07 -25.12 76.3 Favored Glycine 0 C--N 1.339 0.721 0 CA-C-O 120.144 -0.254 . . . . 0.0 112.747 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.3 t -89.28 -5.96 57.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.481 0.712 . . . . 0.0 111.38 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.0 m -66.03 143.21 57.5 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.956 0.502 . . . . 0.0 110.684 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -111.65 8.21 20.73 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.624 0.769 . . . . 0.0 110.742 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 23.4 m -77.38 91.62 3.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.866 0.867 . . . . 0.0 110.792 -175.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.6 t -104.24 113.05 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.609 0.764 . . . . 0.0 109.827 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.506 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 43.8 mtpt -101.38 110.27 22.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.583 0.753 . . . . 0.0 109.905 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -76.82 94.45 3.88 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-O 122.149 0.976 . . . . 0.0 110.094 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -95.25 7.79 45.08 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 110.707 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 CA--C 1.553 1.065 0 C-N-CA 123.715 0.806 . . . . 0.0 111.344 177.629 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.607 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -159.72 153.79 23.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.469 0.708 . . . . 0.0 110.276 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -100.03 152.09 20.62 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.932 173.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -133.08 114.66 14.17 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.872 0.869 . . . . 0.0 109.18 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.562 HD22 ' HB2' ' A' ' 52' ' ' LYS . 40.8 tp -80.5 98.32 7.52 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -102.45 179.5 4.28 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.448 1.099 . . . . 0.0 109.306 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -146.48 145.07 30.06 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 168.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.3 m -81.45 -173.35 4.32 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.279 0.632 . . . . 0.0 111.422 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -63.06 -22.6 66.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.799 0.84 . . . . 0.0 111.115 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.26 -16.74 61.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.501 1.12 . . . . 0.0 111.95 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 71.58 11.27 6.49 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.543 1.537 . . . . 0.0 111.795 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -81.14 138.09 35.91 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.526 0.73 . . . . 0.0 109.102 174.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -89.57 138.36 31.53 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 110.33 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -149.5 130.89 14.71 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.118 0.967 . . . . 0.0 108.99 -168.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -90.77 143.49 26.68 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.77 131.64 71.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 166.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.26 110.18 22.41 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -98.39 123.51 42.56 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 171.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.96 178.87 0.75 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.578 0.751 . . . . 0.0 111.478 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.91 -20.83 54.35 Favored Glycine 0 CA--C 1.54 1.65 0 CA-C-O 121.105 0.28 . . . . 0.0 112.652 172.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.82 -23.29 65.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.367 1.467 . . . . 0.0 111.993 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.16 -3.86 82.58 Favored Glycine 0 C--N 1.35 1.31 0 C-N-CA 123.307 0.48 . . . . 0.0 112.521 -173.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -88.28 134.08 33.89 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.775 1.23 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -71.85 120.53 17.58 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.3 pt -108.3 -25.55 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 125.041 1.337 . . . . 0.0 110.867 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.4 tp -140.32 151.42 45.03 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.286 1.034 . . . . 0.0 108.552 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.0 m -151.01 110.62 4.02 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.097 0.959 . . . . 0.0 108.649 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.458 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 18.8 m -63.57 165.32 8.22 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.314 0.646 . . . . 0.0 110.942 175.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.96 179.82 4.71 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.283 0.563 . . . . 0.0 111.414 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.74 114.75 22.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -106.17 142.39 35.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.197 0.999 . . . . 0.0 109.384 -178.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.0 t -65.52 -26.72 68.03 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.407 0.683 . . . . 0.0 111.454 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -139.41 150.42 45.24 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.01 0.924 . . . . 0.0 109.559 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HB2' HD22 ' A' ' 23' ' ' LEU . 20.3 pttm -62.67 -26.57 68.72 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.613 0.571 . . . . 0.0 110.841 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 82.1 p -50.97 -47.36 61.31 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.091 1.357 . . . . 0.0 112.122 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.2 m -71.71 -26.63 62.57 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.74 . . . . 0.0 111.552 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.75 63.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.616 0.767 . . . . 0.0 110.23 174.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.83 -37.82 76.34 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.097 0.959 . . . . 0.0 110.206 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' A' ' 53' ' ' THR . 29.2 mtpp -66.47 -33.53 75.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.608 170.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.06 -49.78 74.62 Favored Glycine 0 C--N 1.35 1.339 0 O-C-N 124.071 0.857 . . . . 0.0 112.762 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.507 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -70.42 -36.11 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 117.15 0.475 . . . . 0.0 110.9 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.54 -39.33 79.9 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.114 0.483 . . . . 0.0 110.301 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.1 m -74.47 -43.28 56.82 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.858 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.507 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -66.1 -28.79 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 119.11 0.868 . . . . 0.0 110.319 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.4 tpt85 -68.16 -39.23 82.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.678 0.791 . . . . 0.0 109.869 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.7 m -78.35 -24.05 46.65 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.691 0.796 . . . . 0.0 111.509 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -105.32 13.69 30.02 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.107 0.963 . . . . 0.0 111.21 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.9 m -55.93 -45.36 99.91 Favored Pre-proline 0 CA--C 1.569 1.676 0 C-N-CA 123.591 0.756 . . . . 0.0 112.148 172.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -87.93 -14.09 3.63 Favored 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 121.796 1.664 . . . . 0.0 113.951 175.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.38 93.12 4.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.033 0.533 . . . . 0.0 110.769 -170.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.09 -32.37 72.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.948 1.299 . . . . 0.0 112.565 -173.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -68.85 -26.04 64.95 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.551 0.74 . . . . 0.0 111.041 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -77.06 -26.05 53.13 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.572 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HB3' HD13 ' A' ' 110' ' ' ILE . 95.9 m-85 -82.58 97.12 8.31 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 171.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -110.28 146.42 35.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.83 0.452 . . . . 0.0 109.888 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -87.01 149.32 24.84 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.798 1.239 . . . . 0.0 109.469 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -155.77 129.15 8.28 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.209 0.603 . . . . 0.0 109.857 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 48.2 m -92.27 121.42 33.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.954 0.502 . . . . 0.0 109.658 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 160.98 6.24 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.248 1.019 . . . . 0.0 111.908 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.2 t -72.37 -9.99 59.21 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.803 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -72.44 -10.32 59.65 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.744 0.818 . . . . 0.0 111.199 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.47 -6.05 84.02 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.35 0.5 . . . . 0.0 112.523 -175.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -92.28 159.15 15.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.735 0.814 . . . . 0.0 110.333 -174.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -105.75 128.89 53.97 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 -166.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.498 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 26.5 p90 -139.2 177.83 7.62 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -123.76 171.27 9.75 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.086 0.47 . . . . 0.0 110.07 176.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.08 121.78 9.24 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 124.154 0.981 . . . . 0.0 108.434 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.537 HD23 HD13 ' A' ' 94' ' ' ILE . 1.6 tt -83.64 97.99 9.38 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -84.46 145.7 28.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.324 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -110.99 170.78 7.87 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.624 0.769 . . . . 0.0 110.839 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.29 -9.4 53.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.889 0.876 . . . . 0.0 111.673 173.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -88.01 6.26 36.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.229 1.011 . . . . 0.0 111.883 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 77.4 m80 69.92 -2.74 1.93 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 125.058 1.343 . . . . 0.0 112.34 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -99.06 150.98 21.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.432 0.693 . . . . 0.0 109.626 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.6 HG21 ' HB3' ' A' ' 96' ' ' SER . 50.4 mt -87.52 108.92 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 173.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.537 HD13 HD23 ' A' ' 86' ' ' LEU . 9.9 pt -79.32 -5.83 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.729 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . 178.67 113.91 0.39 Allowed Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 173.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 93' ' ' ILE . 52.5 p -112.33 151.22 29.98 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.917 0.858 . . . . 0.0 109.743 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.9 t -81.11 166.49 20.65 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.31 -78.02 0.15 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.15 0.58 . . . . 0.0 109.87 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.498 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 23.3 ptm -175.75 122.51 0.19 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.283 1.033 . . . . 0.0 108.943 -176.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -102.97 115.86 31.43 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.97 90.9 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.039 0.536 . . . . 0.0 110.207 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.0 p -90.23 120.05 31.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.847 0.859 . . . . 0.0 109.226 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -24.64 65.9 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.207 1.003 . . . . 0.0 113.114 -171.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -65.94 -29.39 69.8 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.239 0.616 . . . . 0.0 111.868 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.8 m -71.77 -21.22 61.76 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.871 0.868 . . . . 0.0 111.417 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.72 -40.64 88.48 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.486 0.714 . . . . 0.0 109.529 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.86 -47.38 85.3 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.359 1.063 . . . . 0.0 110.919 174.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.1 m -60.75 -36.52 79.11 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.193 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -62.44 -42.53 99.7 Favored Glycine 0 C--N 1.35 1.311 0 O-C-N 123.627 0.58 . . . . 0.0 112.881 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.46 HD13 ' HB3' ' A' ' 72' ' ' TYR . 32.5 mm -58.09 -47.1 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.197 0.599 . . . . 0.0 110.145 175.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.87 -32.3 72.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.207 1.003 . . . . 0.0 111.602 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.0 t -74.2 -41.53 61.25 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.274 0.63 . . . . 0.0 110.306 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.1 t -75.91 -26.34 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.192 0.597 . . . . 0.0 110.684 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -64.41 -39.79 94.52 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.204 0.602 . . . . 0.0 109.845 169.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.1 -47.02 21.61 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.128 0.971 . . . . 0.0 111.878 -177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -101.58 -2.72 29.85 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.674 0.79 . . . . 0.0 112.195 -170.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -75.91 -8.88 85.12 Favored Glycine 0 N--CA 1.475 1.287 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 82.7 p -80.25 -12.84 59.58 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.28 1.032 . . . . 0.0 111.567 174.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.8 m -69.97 118.23 12.55 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.904 0.882 . . . . 0.0 110.733 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -82.94 -17.71 42.65 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.409 0.683 . . . . 0.0 110.766 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.4 m -61.93 92.62 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.942 0.897 . . . . 0.0 112.425 -174.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 84.0 t -88.53 101.39 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.688 170.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -87.21 143.78 27.13 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 169.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -104.73 138.77 40.52 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.278 0.561 . . . . 0.0 110.819 -178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -129.94 -2.31 4.65 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.736 1.214 . . . . 0.0 109.912 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 37.1 p . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.043 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.465 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . . . . . . 0 C--O 1.241 0.579 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.463 ' HA ' HG22 ' A' ' 121' ' ' THR . 48.2 p90 -154.76 168.84 25.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.677 0.791 . . . . 0.0 111.103 -171.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 46.1 m-85 -110.57 148.8 31.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.67 1.188 . . . . 0.0 108.438 172.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.583 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 39.3 mt-10 -133.39 111.28 10.64 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 171.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.465 HD11 ' HB3' ' A' ' 31' ' ' PHE . 26.9 tp -83.37 100.29 10.59 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.417 0.627 . . . . 0.0 109.606 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m -93.83 178.41 5.68 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.688 1.195 . . . . 0.0 110.051 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -130.37 163.13 27.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.554 0.742 . . . . 0.0 109.442 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -120.98 -169.46 1.84 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.763 0.825 . . . . 0.0 110.523 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.0 m -63.46 -30.43 71.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.96 0.904 . . . . 0.0 112.657 -170.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -89.0 12.51 15.27 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.146 0.578 . . . . 0.0 111.267 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.6 t30 63.36 20.91 12.53 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.046 1.339 . . . . 0.0 110.48 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.23 142.08 28.17 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.732 0.813 . . . . 0.0 110.169 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HB3' HD11 ' A' ' 23' ' ' LEU . 79.7 m-85 -90.96 130.71 36.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.905 1.282 . . . . 0.0 110.742 -165.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 46' ' ' SER . 47.5 ttm-85 -134.88 127.34 30.52 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.749 1.22 . . . . 0.0 108.611 -174.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.97 135.16 33.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.5 m -113.96 131.31 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 165.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.6 OUTLIER -104.56 115.66 30.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -113.92 138.88 49.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.506 0.722 . . . . 0.0 109.684 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 174.4 11.63 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.217 0.607 . . . . 0.0 109.941 170.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.84 -14.78 68.25 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.972 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -70.8 -11.56 61.03 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.722 1.209 . . . . 0.0 111.478 174.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 88.4 0.5 82.32 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.908 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -96.42 141.73 29.37 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.699 0.799 . . . . 0.0 110.997 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.4 m -79.1 119.89 22.86 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.011 0.819 . . . . 0.0 109.335 175.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 26.2 pt -92.35 -30.53 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.271 1.028 . . . . 0.0 111.106 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.4 tp -148.55 150.59 33.62 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.808 0.843 . . . . 0.0 109.131 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.467 HG23 HH11 ' A' ' 32' ' ' ARG . 55.6 m -136.31 109.92 8.03 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 13.2 m -66.83 153.3 43.75 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.449 0.7 . . . . 0.0 109.682 173.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -82.89 -167.91 1.84 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.117 0.567 . . . . 0.0 112.195 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.18 145.21 37.8 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.464 0.706 . . . . 0.0 111.731 -173.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.489 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 96.2 m-85 -134.65 133.61 40.29 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.35 1.46 . . . . 0.0 107.732 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.4 m -61.39 -36.94 81.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.123 0.569 . . . . 0.0 110.707 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.6 m -126.31 150.68 48.34 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.333 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -67.99 -24.51 65.14 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.349 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -62.17 -36.34 81.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.45 0.7 . . . . 0.0 111.464 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.489 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.7 m -69.63 -35.38 75.18 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.229 0.612 . . . . 0.0 109.974 173.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.0 69.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.778 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -67.84 -34.82 77.45 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.25 0.62 . . . . 0.0 110.303 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -67.14 -35.88 80.67 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.099 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.21 -49.33 71.97 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 123.925 0.766 . . . . 0.0 113.337 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.5 tt -67.74 -33.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 116.961 0.38 . . . . 0.0 111.008 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.19 -37.61 87.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.845 0.458 . . . . 0.0 110.406 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.9 m -74.41 -39.5 62.61 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.029 -178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 20.2 m -67.23 -33.41 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.774 0.715 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -73.91 -35.16 64.6 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.894 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.6 t -76.25 -21.48 56.29 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.522 0.729 . . . . 0.0 110.673 176.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.571 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 0.9 OUTLIER -95.06 8.33 43.3 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.917 0.887 . . . . 0.0 110.885 176.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 39.8 t -67.49 -47.45 47.15 Favored Pre-proline 0 CA--C 1.572 1.819 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.397 171.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.93 -26.37 26.83 Favored 'Trans proline' 0 C--N 1.4 3.263 0 C-N-CA 121.957 1.771 . . . . 0.0 112.142 168.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 65' ' ' ASN . 12.0 mm100 -92.55 46.69 1.26 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.899 0.88 . . . . 0.0 109.191 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -67.44 -13.02 61.65 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -73.37 -26.04 60.84 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.786 0.834 . . . . 0.0 110.562 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.421 HH21 ' HG2' ' A' ' 73' ' ' GLU . 3.6 tpm_? -70.78 -16.29 62.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.899 0.88 . . . . 0.0 112.269 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -63.46 122.48 16.37 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 168.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HG2' HH21 ' A' ' 71' ' ' ARG . 38.0 mt-10 -94.6 110.92 22.7 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -172.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.03 104.31 1.11 Allowed 'General case' 0 C--N 1.353 0.741 0 O-C-N 123.9 0.75 . . . . 0.0 110.062 -178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -95.37 143.93 26.33 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.664 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.5 m -127.24 115.43 19.03 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.74 155.48 37.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.674 0.79 . . . . 0.0 110.573 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -68.63 -13.12 62.14 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.53 0.732 . . . . 0.0 110.685 175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -77.31 4.65 10.22 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.024 0.929 . . . . 0.0 111.713 172.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.21 17.86 77.67 Favored Glycine 0 C--N 1.351 1.413 0 C-N-CA 122.885 0.278 . . . . 0.0 113.089 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -104.7 125.8 51.15 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.831 0.852 . . . . 0.0 110.274 -176.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -79.7 137.42 37.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 172.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -150.83 176.81 10.71 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -138.21 140.82 39.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 122.048 -0.408 . . . . 0.0 110.483 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -110.74 114.34 27.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 171.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -80.73 125.29 29.87 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -109.58 138.99 45.13 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.071 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.22 161.81 13.95 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.44 0.696 . . . . 0.0 110.685 175.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.72 69.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.921 0.888 . . . . 0.0 111.323 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.41 12.26 3.81 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.555 1.142 . . . . 0.0 112.539 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 66.35 14.11 9.53 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.853 1.261 . . . . 0.0 111.677 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -88.9 128.85 35.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.494 0.718 . . . . 0.0 109.135 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.8 96.91 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.7 pt -83.46 -7.07 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.081 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -162.59 145.18 10.36 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 173.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.9 p -155.45 118.78 4.4 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.3 t -81.76 164.42 21.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 122.758 0.423 . . . . 0.0 110.615 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -75.02 -84.59 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.119 0.568 . . . . 0.0 110.085 -176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 12.7 ptp -164.55 129.73 2.74 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.975 0.91 . . . . 0.0 109.504 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.462 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 81.0 m-85 -104.25 131.76 51.22 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.649 0.78 . . . . 0.0 109.719 173.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.37 -31.37 72.02 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.958 0.903 . . . . 0.0 111.645 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 17.5 p -140.81 165.64 26.96 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.976 0.91 . . . . 0.0 110.557 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -30.7 69.53 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.399 1.08 . . . . 0.0 112.065 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -61.11 -37.44 82.8 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 123.953 0.783 . . . . 0.0 111.385 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.462 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 21.5 m -74.58 -30.78 61.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.01 0.924 . . . . 0.0 110.569 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -39.4 88.69 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.085 0.954 . . . . 0.0 110.089 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.43 -36.93 77.14 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.795 0.838 . . . . 0.0 110.71 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.0 m -62.86 -37.63 87.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.529 0.732 . . . . 0.0 109.482 172.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.412 ' O ' HG21 ' A' ' 113' ' ' VAL . . . -61.92 -48.56 82.84 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.427 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.0 mm -55.23 -50.01 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.331 0.652 . . . . 0.0 110.095 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.69 -39.35 84.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 13.7 t -76.15 -36.01 58.95 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.86 -175.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.412 HG21 ' O ' ' A' ' 109' ' ' GLY . 85.5 t -71.16 -31.9 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 118.141 0.428 . . . . 0.0 110.198 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -69.23 -43.37 74.19 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.633 0.373 . . . . 0.0 110.766 174.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.71 -48.15 56.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.565 0.746 . . . . 0.0 111.327 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.465 ' ND2' ' HA3' ' A' ' 19' ' ' GLY . 22.4 m120 -88.8 -10.54 47.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.874 0.87 . . . . 0.0 111.576 -175.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.44 -37.15 89.93 Favored Glycine 0 C--N 1.346 1.136 0 O-C-N 123.245 0.341 . . . . 0.0 112.785 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.1 t -75.78 -11.14 59.93 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.934 0.894 . . . . 0.0 112.239 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.2 m -69.5 104.56 2.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.179 0.592 . . . . 0.0 110.135 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -86.28 72.47 10.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.222 1.011 . . . . 0.0 108.802 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.463 HG22 ' HA ' ' A' ' 20' ' ' TRP . 2.1 t -145.42 93.83 2.43 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.041 -1.436 . . . . 0.0 108.898 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.2 t -109.24 123.79 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.974 0.91 . . . . 0.0 110.542 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.583 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -100.7 90.26 4.18 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 174.289 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.94 97.16 1.8 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . 0.404 ' ND2' ' HB3' ' A' ' 22' ' ' GLU . 87.2 m-20 -84.54 -4.12 58.79 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.561 1.144 . . . . 0.0 112.445 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 47.3 p . . . . . 0 CA--C 1.543 0.677 0 C-N-CA 123.315 0.646 . . . . 0.0 111.202 -176.975 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.547 0 N-CA-C 111.92 -0.472 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.2 p90 -159.05 150.13 20.12 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.799 0.839 . . . . 0.0 109.88 -178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -90.57 157.48 17.49 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.607 0.763 . . . . 0.0 109.56 172.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 123' ' ' LYS . 55.3 mt-10 -136.09 110.49 8.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.69 0.796 . . . . 0.0 109.565 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' ' 52' ' ' LYS . 29.2 tp -94.18 101.68 13.68 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.197 0.599 . . . . 0.0 109.849 -178.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.558 ' HA ' ' HB3' ' A' ' 125' ' ' ASN . 22.3 m -107.04 174.49 5.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.239 1.016 . . . . 0.0 110.702 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.39 151.65 36.59 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.199 0.999 . . . . 0.0 109.58 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.8 m -89.43 -177.65 5.39 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.771 0.829 . . . . 0.0 111.428 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.6 t -61.92 -34.82 76.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.952 0.901 . . . . 0.0 110.943 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.38 11.52 36.33 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.782 0.833 . . . . 0.0 111.078 176.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 t30 69.42 33.78 3.06 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 125.349 1.46 . . . . 0.0 112.559 174.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -81.12 139.27 35.73 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 121.748 -0.595 . . . . 0.0 110.027 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -90.16 117.47 28.95 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.393 1.077 . . . . 0.0 109.485 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -130.18 119.29 22.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.062 0.945 . . . . 0.0 109.264 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -95.24 130.54 41.94 Favored 'General case' 0 C--O 1.241 0.615 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.477 HG13 HG21 ' A' ' 45' ' ' THR . 20.7 m -106.12 170.75 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 170.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.2 125.27 42.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -112.81 138.81 49.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.97 178.49 1.78 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.454 0.702 . . . . 0.0 111.305 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -19.86 61.46 Favored Glycine 0 C--N 1.35 1.327 0 CA-C-N 116.585 -0.28 . . . . 0.0 113.031 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -67.8 -24.35 65.29 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.598 0.759 . . . . 0.0 111.779 173.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.37 15.5 58.58 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 116.537 -0.302 . . . . 0.0 113.025 -175.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -106.77 141.46 37.98 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.421 0.689 . . . . 0.0 110.317 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.9 m -67.77 122.29 17.79 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 123.602 0.564 . . . . 0.0 110.861 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.5 pt -109.85 -18.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.775 1.23 . . . . 0.0 110.651 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 tp -151.06 145.94 25.84 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.477 HG21 HG13 ' A' ' 34' ' ' VAL . 92.5 m -146.4 119.06 8.56 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.842 0.857 . . . . 0.0 108.813 178.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -82.0 177.26 8.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.919 0.487 . . . . 0.0 111.335 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -73.22 175.43 6.82 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.346 1.059 . . . . 0.0 111.725 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.0 114.65 27.25 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.414 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -99.56 147.33 25.45 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.069 0.948 . . . . 0.0 109.323 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.6 p -81.09 -31.99 34.1 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.83 0.452 . . . . 0.0 111.297 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.2 m -109.15 143.7 38.2 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.953 0.901 . . . . 0.0 109.703 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HG3' HD23 ' A' ' 23' ' ' LEU . 87.3 tttt -67.93 -37.89 82.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.978 0.511 . . . . 0.0 110.412 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.172 0.989 . . . . 0.0 111.695 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 m -64.12 -39.2 93.52 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.072 0.949 . . . . 0.0 111.25 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.97 -34.67 66.61 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.578 0.751 . . . . 0.0 110.886 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.94 -29.63 65.71 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.575 0.75 . . . . 0.0 111.1 177.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -77.96 -27.41 49.23 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.322 0.249 . . . . 0.0 111.275 170.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.85 -40.84 99.37 Favored Glycine 0 C--N 1.344 1.002 0 O-C-N 123.525 0.516 . . . . 0.0 112.827 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.4 tt -68.01 -32.82 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 120.91 0.386 . . . . 0.0 111.067 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.17 74.15 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.071 0.548 . . . . 0.0 110.677 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -70.84 -50.83 31.11 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.879 0.871 . . . . 0.0 111.344 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 59' ' ' ILE . 30.7 m -66.18 -28.84 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.293 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -53.16 -50.97 63.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.681 0.793 . . . . 0.0 110.334 -178.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -80.79 -31.99 35.54 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.826 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -96.06 -8.4 33.6 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 p -65.28 -37.02 17.24 Favored Pre-proline 0 CA--C 1.566 1.584 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -74.13 -7.9 20.37 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.768 1.645 . . . . 0.0 112.993 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.79 88.93 4.44 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 122.923 0.489 . . . . 0.0 109.768 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.439 ' HA ' ' HD1' ' A' ' 72' ' ' TYR . 12.2 pt-20 -62.02 -20.19 63.65 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.801 0.84 . . . . 0.0 111.685 176.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -54.3 -40.74 68.2 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.457 1.103 . . . . 0.0 112.044 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -83.69 -9.43 58.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.514 0.726 . . . . 0.0 112.095 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 85' ' ' ASN . 88.8 m-85 -84.01 124.65 31.28 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.454 ' HB2' ' ND2' ' A' ' 85' ' ' ASN . 41.9 mt-10 -95.5 104.11 16.0 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 173.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -73.14 101.77 3.41 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.731 0.777 . . . . 0.0 109.136 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.542 ' HE2' ' ND2' ' A' ' 85' ' ' ASN . 65.9 mttm -102.57 165.05 11.31 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.513 1.125 . . . . 0.0 109.937 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.8 m -126.3 112.2 15.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.312 0.645 . . . . 0.0 109.605 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.0 165.54 6.8 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.841 0.856 . . . . 0.0 111.02 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -64.3 -16.31 61.92 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.585 0.754 . . . . 0.0 111.98 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -81.35 -2.05 47.75 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.956 0.902 . . . . 0.0 111.986 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 77.94 14.97 81.76 Favored Glycine 0 C--N 1.349 1.27 0 C-N-CA 122.831 0.253 . . . . 0.0 112.935 -176.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.64 142.68 29.15 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.886 0.874 . . . . 0.0 109.535 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -101.23 125.48 47.86 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.865 0.466 . . . . 0.0 109.832 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.466 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 35.7 p90 -131.74 170.54 14.67 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.495 ' HB2' ' HB3' ' A' ' 97' ' ' SER . 16.6 m-85 -131.22 166.89 20.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.942 0.497 . . . . 0.0 110.142 -173.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.542 ' ND2' ' HE2' ' A' ' 75' ' ' LYS . 4.0 p30 -149.77 133.06 16.45 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 167.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.78 116.24 27.73 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -96.88 140.47 31.39 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.933 -176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -98.15 166.04 11.6 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.826 0.85 . . . . 0.0 109.748 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.07 -13.84 62.32 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.088 0.555 . . . . 0.0 111.634 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.476 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 64.4 m-20 -80.1 4.1 18.34 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.816 0.847 . . . . 0.0 111.296 174.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 74.3 m80 67.25 15.46 9.99 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.02 1.328 . . . . 0.0 111.788 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.476 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 13.4 pt20 -97.67 147.02 24.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.194 0.598 . . . . 0.0 110.426 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.96 99.72 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 13.0 pt -81.22 -16.51 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.756 -177.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.83 103.26 0.2 Allowed Glycine 0 C--N 1.35 1.335 0 C-N-CA 121.701 -0.285 . . . . 0.0 113.046 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.482 ' HA ' ' HA ' ' A' ' 85' ' ' ASN . 39.8 t -92.86 113.56 25.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.661 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.495 ' HB3' ' HB2' ' A' ' 84' ' ' PHE . 46.6 t -81.8 135.85 35.43 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -75.43 172.5 12.4 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.466 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.07 118.08 16.6 Favored 'General case' 0 C--N 1.351 0.651 0 CA-C-O 121.801 0.81 . . . . 0.0 112.045 -171.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -93.95 137.09 33.55 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.485 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.16 -56.51 4.58 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.259 0.624 . . . . 0.0 110.818 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.3 p -88.26 151.68 22.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.511 0.724 . . . . 0.0 112.241 -171.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.91 -24.84 60.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.407 1.083 . . . . 0.0 111.973 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -65.81 -37.56 86.58 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.5 m -74.75 -18.59 60.47 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.249 1.02 . . . . 0.0 111.816 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -60.75 -48.95 79.46 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 173.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.7 -48.13 23.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.958 0.903 . . . . 0.0 111.043 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.8 m -61.38 -28.72 69.44 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.704 0.802 . . . . 0.0 111.265 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.427 ' O ' HG21 ' A' ' 113' ' ' VAL . . . -66.26 -51.65 42.22 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.744 178.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.7 mm -65.48 -38.07 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 122.843 0.457 . . . . 0.0 110.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -30.57 71.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.961 0.904 . . . . 0.0 111.486 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.91 -50.08 18.08 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.427 HG21 ' O ' ' A' ' 109' ' ' GLY . 66.2 t -62.17 -36.63 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 C-N-CA 122.972 0.509 . . . . 0.0 111.778 -175.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -69.95 -39.44 76.03 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 120.705 0.288 . . . . 0.0 111.337 178.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.48 -41.57 46.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.326 0.651 . . . . 0.0 111.434 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -91.08 -10.77 40.84 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.5 0.72 . . . . 0.0 110.782 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.22 -12.46 84.58 Favored Glycine 0 C--N 1.354 1.542 0 C-N-CA 122.842 0.258 . . . . 0.0 113.572 177.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.2 p -81.92 -18.31 44.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.259 0.623 . . . . 0.0 111.016 172.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.3 m -76.06 90.34 3.04 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 123.449 0.7 . . . . 0.0 110.046 -178.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -82.93 67.75 9.14 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 122.185 0.993 . . . . 0.0 109.597 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.6 t -136.65 93.3 2.85 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.0 -1.454 . . . . 0.0 109.244 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 35.4 m -85.93 141.4 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.183 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 55.5 tptt -97.07 99.3 10.81 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 174.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.85 95.24 1.91 Allowed 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.134 -175.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . 0.558 ' HB3' ' HA ' ' A' ' 24' ' ' SER . 26.5 t-20 -79.06 -26.64 43.05 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 165.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 CA--C 1.548 0.865 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.35 171.519 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.453 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -147.65 148.32 30.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.038 0.935 . . . . 0.0 109.936 -176.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -97.17 118.83 34.48 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -95.58 109.02 21.32 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.602 HD23 ' HB2' ' A' ' 52' ' ' LYS . 49.4 tp -79.72 101.47 8.43 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -103.52 139.8 38.37 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.922 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HB3' HG23 ' A' ' 126' ' ' THR . 14.8 ptmm? -95.44 130.13 42.36 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 170.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.4 m -83.98 -178.49 6.99 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 109.882 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -59.94 -25.76 65.42 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.066 0.546 . . . . 0.0 112.259 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -102.31 25.71 8.61 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.848 0.859 . . . . 0.0 111.086 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 63.88 12.18 6.58 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 125.035 1.334 . . . . 0.0 112.829 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -69.44 126.25 29.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.344 0.658 . . . . 0.0 110.941 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.48 119.95 30.37 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.195 0.998 . . . . 0.0 109.475 -170.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HB2' HD13 ' A' ' 48' ' ' LEU . 47.2 ttp85 -147.9 117.78 7.17 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.837 0.855 . . . . 0.0 108.972 -173.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -90.99 128.08 36.67 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.513 HG13 HG21 ' A' ' 45' ' ' THR . 30.5 m -107.06 130.89 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.694 0.797 . . . . 0.0 108.892 173.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.2 tp -89.77 112.93 24.37 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -105.29 129.29 53.68 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.305 1.042 . . . . 0.0 109.059 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.31 -176.98 1.99 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.937 0.495 . . . . 0.0 110.995 173.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.41 -15.06 51.39 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 115.434 0.934 . . . . 0.0 115.434 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -79.77 -14.22 58.87 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.473 0.709 . . . . 0.0 111.723 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.09 6.87 78.25 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 -165.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -84.12 117.43 23.46 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 124.465 1.106 . . . . 0.0 109.961 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.7 m -64.93 119.73 11.26 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 171.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.1 pt -104.91 -24.93 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.292 1.037 . . . . 0.0 109.993 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 13.0 tp -145.61 134.26 22.19 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -170.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.513 HG21 HG13 ' A' ' 34' ' ' VAL . 59.7 m -132.74 123.64 26.63 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.759 0.823 . . . . 0.0 108.951 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 t -83.52 -179.29 7.31 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.292 0.637 . . . . 0.0 111.408 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 93' ' ' ILE . 27.1 mm-40 -68.75 170.32 9.68 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.588 0.755 . . . . 0.0 111.643 174.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.445 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.8 mm? -89.65 113.67 25.18 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 171.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.454 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -99.1 152.15 20.17 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 124.42 1.088 . . . . 0.0 109.859 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 65.5 p -82.84 -17.58 43.44 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.515 0.726 . . . . 0.0 110.932 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.0 m -138.23 149.51 45.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.114 0.966 . . . . 0.0 110.076 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.602 ' HB2' HD23 ' A' ' 23' ' ' LEU . 3.1 pptp? -71.88 -27.17 62.67 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.194 0.598 . . . . 0.0 110.444 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 14.8 t -68.77 -27.86 66.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.989 0.516 . . . . 0.0 111.046 174.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.454 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 14.6 m -69.31 -36.42 76.99 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.034 0.534 . . . . 0.0 109.637 174.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.88 -30.94 67.45 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.167 174.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -64.39 -43.64 93.83 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.883 0.873 . . . . 0.0 110.479 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.508 ' HB3' ' HZ1' ' A' ' 57' ' ' LYS . 2.8 mmmp? -64.9 -34.05 77.49 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.981 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.63 -49.55 68.3 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.352 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.9 tt -71.4 -32.24 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 122.607 0.363 . . . . 0.0 111.076 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.95 -38.69 86.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.158 0.504 . . . . 0.0 109.796 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.6 m -71.48 -43.22 66.97 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.796 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 m -62.36 -32.65 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 118.897 0.771 . . . . 0.0 110.608 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.464 HH22 ' N ' ' A' ' 120' ' ' GLN . 14.9 ttm180 -70.39 -40.11 74.15 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.677 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -68.63 -22.28 64.43 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.101 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.462 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 60.7 m-80 -98.54 -1.94 39.91 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.441 0.696 . . . . 0.0 112.156 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.1 m -63.15 -45.76 85.85 Favored Pre-proline 0 CA--C 1.568 1.663 0 CA-C-O 118.275 -0.869 . . . . 0.0 111.657 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.8 -37.88 8.47 Favored 'Trans proline' 0 C--N 1.398 3.158 0 C-N-CA 121.762 1.641 . . . . 0.0 111.812 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG2' ' HA ' ' A' ' 65' ' ' ASN . 9.5 pt20 -98.66 58.28 1.2 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.934 1.35 . . . . 0.0 109.408 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.27 -11.71 34.29 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 113.27 -1.786 . . . . 0.0 112.899 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.19 -25.01 65.03 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.868 0.867 . . . . 0.0 111.894 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.69 -15.6 61.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.011 0.524 . . . . 0.0 112.367 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.82 127.39 31.36 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -96.92 107.33 19.82 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.506 0.722 . . . . 0.0 111.532 -168.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -73.51 112.0 9.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.034 0.534 . . . . 0.0 109.76 174.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -134.36 143.5 47.69 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 171.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.3 m -101.49 133.36 46.26 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.55 0.74 . . . . 0.0 109.71 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.4 11.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.121 0.968 . . . . 0.0 111.649 176.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 p -64.47 -25.97 68.23 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.892 0.877 . . . . 0.0 111.473 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -70.02 -23.75 63.17 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.643 0.777 . . . . 0.0 111.332 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.62 30.91 5.97 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.317 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -113.55 125.9 54.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.409 0.683 . . . . 0.0 110.921 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -83.1 128.6 34.63 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.058 0.943 . . . . 0.0 110.391 -170.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -138.37 173.58 11.46 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -131.09 135.53 47.59 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -115.51 129.51 56.56 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -91.69 99.38 12.29 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 173.362 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -106.55 135.97 47.13 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.216 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' A' ' 94' ' ' ILE . . . -100.85 170.71 8.13 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.33 1.052 . . . . 0.0 111.052 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.11 -8.95 13.72 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.509 0.723 . . . . 0.0 112.936 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.44 ' N ' HD21 ' A' ' 90' ' ' ASN . 0.7 OUTLIER -84.65 7.87 18.86 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.082 0.953 . . . . 0.0 111.311 175.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . 0.446 ' HA ' ' HD3' ' A' ' 87' ' ' LYS . 30.7 m170 63.97 21.94 12.79 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.971 1.309 . . . . 0.0 111.687 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -116.82 129.85 56.34 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.831 0.853 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.573 HG22 ' HB3' ' A' ' 96' ' ' SER . 40.0 mt -74.05 100.73 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 122.076 0.941 . . . . 0.0 109.519 173.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.533 HD13 HD23 ' A' ' 86' ' ' LEU . 16.2 pt -75.66 -6.57 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.279 -176.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.01 99.14 0.13 Allowed Glycine 0 C--N 1.353 1.491 0 CA-C-O 120.082 -0.288 . . . . 0.0 112.528 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.573 ' HB3' HG22 ' A' ' 93' ' ' ILE . 34.3 p -92.45 116.77 29.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.4 t -69.39 164.5 22.84 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 122.975 0.51 . . . . 0.0 111.248 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -73.0 156.12 39.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.54 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 67.7 mtm -72.9 116.97 14.05 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -90.63 143.5 26.68 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 124.003 0.921 . . . . 0.0 109.17 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.04 -39.38 79.23 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.021 0.528 . . . . 0.0 110.675 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 65.3 p -117.16 150.24 39.03 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.696 0.798 . . . . 0.0 110.949 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -69.78 -25.77 63.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.052 0.941 . . . . 0.0 111.909 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.86 -29.98 68.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.686 0.394 . . . . 0.0 111.535 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -71.27 -23.99 62.07 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.123 0.569 . . . . 0.0 111.318 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.427 ' O ' HG12 ' A' ' 110' ' ' ILE . 13.1 ttt180 -61.34 -49.55 76.53 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.203 0.601 . . . . 0.0 109.754 169.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.31 -38.11 88.14 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.155 0.982 . . . . 0.0 111.223 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 48.4 m -66.32 -37.28 85.02 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.178 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.33 -35.84 88.37 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.903 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 106' ' ' ARG . 43.6 mm -59.83 -46.67 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.02 -35.66 81.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.831 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.6 t -71.1 -42.93 68.65 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.708 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.92 -27.08 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.506 0.723 . . . . 0.0 111.058 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -66.04 -47.42 74.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.011 0.925 . . . . 0.0 108.997 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.39 -47.69 22.39 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.647 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.425 ' HB3' HD13 ' A' ' 35' ' ' LEU . 77.9 m-20 -83.66 -14.37 51.98 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.51 0.724 . . . . 0.0 111.952 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -70.62 -30.57 68.53 Favored Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.104 -0.399 . . . . 0.0 112.104 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -91.17 9.18 32.18 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.025 0.93 . . . . 0.0 111.343 175.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -103.51 108.68 20.04 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.182 0.993 . . . . 0.0 108.852 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.464 ' N ' HH22 ' A' ' 63' ' ' ARG . 48.5 tt0 -92.82 38.66 1.03 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.276 0.63 . . . . 0.0 111.108 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.3 m -79.26 75.72 5.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 t -91.04 97.5 7.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -77.54 125.55 29.52 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.652 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -77.47 95.17 4.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 172.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.32 -0.75 57.23 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 121.595 0.712 . . . . 0.0 109.44 174.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 25' ' ' LYS . 25.9 p . . . . . 0 CA--C 1.549 0.908 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 169.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.485 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -145.16 150.06 36.08 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.413 1.085 . . . . 0.0 110.186 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -95.34 153.03 17.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.843 0.857 . . . . 0.0 109.46 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -133.32 109.77 9.6 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.5 tp -82.01 102.0 10.69 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -101.11 -177.63 3.51 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.432 1.093 . . . . 0.0 109.507 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.506 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 18.7 ptpt -138.71 165.9 25.77 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.041 0.536 . . . . 0.0 109.757 169.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.3 t -100.55 -174.07 2.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.861 0.864 . . . . 0.0 108.878 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 t -62.28 -35.28 78.53 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.458 0.703 . . . . 0.0 111.525 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -90.79 26.37 2.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.154 0.582 . . . . 0.0 111.532 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.506 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.2 m-20 62.99 19.22 11.5 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.536 1.134 . . . . 0.0 112.263 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -71.52 116.5 11.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.671 0.788 . . . . 0.0 109.731 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.5 120.61 28.02 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.001 0.521 . . . . 0.0 110.06 -168.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 ttt85 -142.51 116.25 9.23 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.028 1.331 . . . . 0.0 108.116 -170.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -102.91 145.83 29.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.241 0.544 . . . . 0.0 110.597 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.521 HG13 HG23 ' A' ' 45' ' ' THR . 29.5 m -106.86 171.4 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 108.789 175.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 24.3 tp -137.54 109.56 7.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 173.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 65.5 mttm -95.14 141.93 28.18 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 178.05 7.01 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 168.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.52 -18.22 63.21 Favored Glycine 0 N--CA 1.48 1.596 0 C-N-CA 122.898 0.285 . . . . 0.0 113.035 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -63.73 -21.57 66.47 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 125.156 1.382 . . . . 0.0 111.89 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.82 2.22 75.66 Favored Glycine 0 C--N 1.35 1.354 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -173.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -98.35 130.43 45.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.918 1.287 . . . . 0.0 109.818 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 30.4 m -72.34 121.47 19.53 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.391 0.615 . . . . 0.0 110.532 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -99.99 -24.37 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.92 1.288 . . . . 0.0 111.5 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -146.1 143.62 29.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.521 HG23 HG13 ' A' ' 34' ' ' VAL . 48.2 m -146.15 114.48 6.68 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.308 0.643 . . . . 0.0 109.71 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 m -69.39 164.29 23.3 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.931 0.892 . . . . 0.0 111.347 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -83.39 178.19 8.15 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.394 0.616 . . . . 0.0 111.948 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.57 113.36 11.74 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.222 -177.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.4 ' HH ' ' HA ' ' A' ' 94' ' ' ILE . 96.9 m-85 -95.76 156.78 16.18 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.006 0.922 . . . . 0.0 109.002 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.7 m -82.31 -24.47 34.61 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 173.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.7 t -126.61 146.87 50.0 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.365 0.666 . . . . 0.0 111.316 -174.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -75.08 -27.84 60.09 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.207 176.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.7 m -63.49 -38.42 91.07 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.54 1.536 . . . . 0.0 110.925 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.3 m -65.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.551 0.74 . . . . 0.0 110.606 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.31 -30.81 57.87 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.158 0.983 . . . . 0.0 111.92 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -73.98 -38.08 64.26 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.516 0.726 . . . . 0.0 110.143 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.537 ' HZ1' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -76.86 -22.79 52.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.248 169.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.97 93.36 Favored Glycine 0 C--N 1.349 1.281 0 O-C-N 123.745 0.653 . . . . 0.0 112.655 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.518 ' HA ' HG21 ' A' ' 62' ' ' VAL . 5.7 tt -65.55 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 122.341 0.256 . . . . 0.0 110.37 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -35.76 81.56 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.074 0.55 . . . . 0.0 110.893 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.9 m -73.7 -43.84 58.17 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.57 0.748 . . . . 0.0 111.621 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' A' ' 59' ' ' ILE . 18.8 m -70.11 -29.11 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.533 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -67.89 -45.14 75.33 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.919 0.888 . . . . 0.0 108.887 176.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 42.6 t -64.97 -15.79 62.63 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.076 0.95 . . . . 0.0 111.892 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.99 18.47 9.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.443 0.697 . . . . 0.0 112.392 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -63.19 -45.85 85.67 Favored Pre-proline 0 CA--C 1.567 1.619 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.195 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.64 -12.81 11.03 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 121.614 1.543 . . . . 0.0 113.093 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -75.98 84.66 2.88 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.484 0.659 . . . . 0.0 110.868 -173.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.06 -28.7 70.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.147 1.379 . . . . 0.0 112.045 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -63.24 -35.82 81.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.659 0.783 . . . . 0.0 110.824 174.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.43 ' HA ' ' NE ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.19 -19.99 35.48 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.453 -174.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -70.83 106.3 3.55 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 167.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -97.63 107.4 19.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.434 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.99 123.69 43.45 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.118 0.967 . . . . 0.0 109.75 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -132.99 150.65 52.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.844 1.257 . . . . 0.0 109.633 -175.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.2 m -92.79 117.26 29.82 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.581 0.752 . . . . 0.0 109.518 171.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.86 163.53 7.46 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.078 0.951 . . . . 0.0 112.235 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -68.58 -14.68 63.18 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.269 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -82.79 1.87 36.85 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.086 0.955 . . . . 0.0 111.772 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.81 32.91 58.52 Favored Glycine 0 C--N 1.353 1.506 0 C-N-CA 123.121 0.391 . . . . 0.0 112.951 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 74.8 mmtt -122.94 150.28 43.16 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.114 0.965 . . . . 0.0 109.728 -177.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -96.57 126.82 42.02 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.307 0.643 . . . . 0.0 109.987 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -137.79 176.69 8.48 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -141.46 166.14 25.56 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.907 0.483 . . . . 0.0 110.116 173.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.51 135.57 20.12 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.663 HD12 HD13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -88.51 119.41 28.93 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -93.16 139.28 30.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.318 1.047 . . . . 0.0 109.896 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.2 176.1 7.09 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.279 0.632 . . . . 0.0 110.643 177.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.63 -23.71 65.38 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 121.448 0.642 . . . . 0.0 110.126 169.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -79.56 -3.81 48.6 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.728 174.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.6 m80 65.42 15.57 10.09 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 125.737 1.615 . . . . 0.0 111.235 -175.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -88.23 154.7 20.22 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 123.703 0.801 . . . . 0.0 110.048 177.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.475 HG23 ' HB2' ' A' ' 96' ' ' SER . 13.9 mm -84.14 99.16 6.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.663 HD13 HD12 ' A' ' 86' ' ' LEU . 10.0 pt -83.6 -8.38 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 122.801 0.44 . . . . 0.0 111.82 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.76 103.85 0.19 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.802 -0.443 . . . . 0.0 112.293 176.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.475 ' HB2' HG23 ' A' ' 93' ' ' ILE . 34.6 t -100.57 119.39 38.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.805 0.842 . . . . 0.0 109.229 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.3 t -73.77 167.33 21.63 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.94 0.496 . . . . 0.0 110.8 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.44 ' NE2' ' HB ' ' A' ' 42' ' ' THR . 77.5 mt-30 -85.38 166.63 16.26 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.382 0.673 . . . . 0.0 110.494 177.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 72.1 mtm -74.35 118.63 17.54 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.579 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -94.41 144.3 25.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.124 0.97 . . . . 0.0 109.005 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.526 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -62.25 -58.02 9.28 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.418 0.687 . . . . 0.0 110.707 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.7 p -110.73 169.15 8.95 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.022 0.929 . . . . 0.0 110.954 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.74 -30.01 65.15 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.97 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -64.41 -32.49 74.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.109 0.564 . . . . 0.0 110.971 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.4 t -79.05 -32.89 45.02 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.755 0.822 . . . . 0.0 110.426 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -69.22 -38.72 78.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.724 0.81 . . . . 0.0 111.515 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -75.61 -29.87 59.38 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 122.95 0.5 . . . . 0.0 111.281 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 47.0 m -65.83 -34.31 77.86 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.43 -46.22 93.11 Favored Glycine 0 C--N 1.351 1.372 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.153 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.0 mm -55.09 -46.84 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.54 0.736 . . . . 0.0 109.839 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.22 93.16 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.9 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.7 t -71.63 -46.57 58.66 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.205 0.602 . . . . 0.0 110.361 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 81.0 t -64.86 -30.9 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.943 0.897 . . . . 0.0 111.124 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.92 -51.5 54.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.362 0.665 . . . . 0.0 110.405 173.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.84 -20.94 55.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.802 0.841 . . . . 0.0 112.431 -172.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -112.17 -8.16 14.01 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.824 0.849 . . . . 0.0 111.051 -178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.74 -28.13 65.72 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 172.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.533 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 12.6 t -74.25 -9.36 58.53 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.0 0.92 . . . . 0.0 111.83 175.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.4 t -72.92 147.01 45.71 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.206 0.602 . . . . 0.0 109.437 176.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -131.46 25.21 4.8 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.589 0.756 . . . . 0.0 110.657 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.4 t -95.88 110.84 22.96 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 172.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.3 t -119.27 117.32 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 110.209 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -78.27 135.74 37.61 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.124 . . . . 0.0 109.182 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -89.02 107.99 19.34 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -114.76 15.39 17.52 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.657 0.783 . . . . 0.0 110.305 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.6 p . . . . . 0 N--CA 1.485 1.29 0 C-N-CA 123.431 0.692 . . . . 0.0 111.745 -175.351 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.529 0 CA-C-O 121.094 0.274 . . . . 0.0 113.751 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -165.39 155.52 13.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.296 1.038 . . . . 0.0 109.842 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' A' ' 35' ' ' LEU . 59.6 m-85 -97.4 148.41 23.21 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.575 0.75 . . . . 0.0 109.937 169.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.545 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -129.75 117.61 20.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.852 0.861 . . . . 0.0 108.703 170.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 31' ' ' PHE . 28.7 tp -81.63 102.45 10.68 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 175.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.1 m -106.49 162.84 13.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.217 1.007 . . . . 0.0 108.816 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -121.44 165.68 15.23 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 61.0 p -96.75 173.79 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 123.932 0.893 . . . . 0.0 110.034 176.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.1 t -67.46 -21.72 65.53 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.351 0.596 . . . . 0.0 110.244 171.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.78 -13.14 60.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.321 1.048 . . . . 0.0 111.657 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 86.0 -7.04 0.8 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 126.348 1.859 . . . . 0.0 112.4 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.636 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 8.7 mp0 -65.63 132.96 50.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.196 0.598 . . . . 0.0 110.675 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.517 ' HB3' HD11 ' A' ' 23' ' ' LEU . 83.7 m-85 -91.31 148.54 22.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.358 1.063 . . . . 0.0 110.58 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -152.59 129.9 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.433 0.693 . . . . 0.0 109.306 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -91.21 126.93 36.45 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 173.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.38 130.27 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -99.25 123.01 43.2 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 173.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -118.68 149.51 41.29 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.259 1.024 . . . . 0.0 108.901 177.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.84 -179.15 6.4 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.441 0.696 . . . . 0.0 110.242 172.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.44 -20.27 65.41 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-O 120.997 0.221 . . . . 0.0 112.99 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -78.43 -10.3 59.64 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.293 1.037 . . . . 0.0 111.186 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.81 -0.66 89.15 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 123.035 0.35 . . . . 0.0 113.067 -175.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.38 121.76 20.06 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.064 0.945 . . . . 0.0 110.132 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 m -71.39 120.2 16.63 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.421 HD11 ' HG ' ' A' ' 35' ' ' LEU . 26.7 pt -109.98 -8.35 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.699 1.2 . . . . 0.0 111.159 -177.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 16.9 tp -164.31 151.25 11.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.153 0.581 . . . . 0.0 110.487 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 46.7 m -146.1 126.34 13.89 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.466 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 87.3 p -67.01 155.13 39.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.35 0.66 . . . . 0.0 111.031 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.86 138.39 58.14 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.636 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 10.4 mp -64.07 111.97 2.77 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.199 0.523 . . . . 0.0 110.582 -173.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.42 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.3 m-85 -82.34 147.6 28.76 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.247 1.019 . . . . 0.0 110.657 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 m -69.76 -37.24 76.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.562 0.745 . . . . 0.0 110.886 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -112.69 155.33 24.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.564 0.746 . . . . 0.0 110.848 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -62.91 -43.18 99.48 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.946 0.898 . . . . 0.0 109.14 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.5 p -61.02 -40.78 94.85 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.086 0.866 . . . . 0.0 110.917 -177.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.42 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 20.0 m -63.13 -39.97 96.23 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.613 0.765 . . . . 0.0 110.931 178.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.2 84.32 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.527 0.731 . . . . 0.0 110.992 176.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -68.66 -32.11 71.71 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.667 0.787 . . . . 0.0 111.082 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -77.82 -22.94 49.25 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.086 0.554 . . . . 0.0 110.949 171.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.57 94.83 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.819 0.699 . . . . 0.0 113.778 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.419 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.5 tt -64.16 -37.79 80.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 117.02 0.41 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.96 71.27 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.289 0.635 . . . . 0.0 110.952 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 m -73.14 -49.96 25.32 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.624 177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.419 HG21 ' HA ' ' A' ' 59' ' ' ILE . 26.0 m -65.46 -38.8 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.538 -173.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -65.56 -32.99 74.88 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.074 0.464 . . . . 0.0 110.923 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 t -74.27 -24.53 59.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.594 0.758 . . . . 0.0 111.03 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -107.41 3.1 24.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.312 0.645 . . . . 0.0 111.469 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 75.7 m -63.76 -43.6 77.22 Favored Pre-proline 0 N--CA 1.487 1.393 0 CA-C-O 118.545 -0.741 . . . . 0.0 112.768 174.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -83.95 18.93 1.44 Allowed 'Trans proline' 0 C--N 1.38 2.222 0 CA-C-N 121.657 1.628 . . . . 0.0 113.02 175.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -118.79 96.63 5.34 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.09 0.956 . . . . 0.0 109.895 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -26.7 68.4 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.917 0.487 . . . . 0.0 110.199 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -45.88 -40.8 10.49 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.815 1.646 . . . . 0.0 112.513 171.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -90.06 -23.82 21.33 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.338 0.655 . . . . 0.0 111.253 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -70.41 118.41 13.19 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 120.649 0.262 . . . . 0.0 110.333 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -96.04 98.64 10.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -66.45 103.61 1.08 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -124.87 139.77 53.53 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.642 0.777 . . . . 0.0 109.731 -164.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -97.28 127.93 43.68 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.228 0.611 . . . . 0.0 110.083 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.28 150.67 40.1 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.887 0.875 . . . . 0.0 110.71 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 t -71.4 -8.17 52.08 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 121.313 0.578 . . . . 0.0 110.016 171.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.529 HD21 ' HG2' ' A' ' 99' ' ' MET . 62.0 m-20 -74.57 -3.74 32.84 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.557 1.143 . . . . 0.0 111.906 169.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.94 13.51 82.08 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 123.042 0.353 . . . . 0.0 112.625 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -110.64 178.42 4.37 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.208 1.003 . . . . 0.0 110.202 -177.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -126.3 127.77 46.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.69 0.396 . . . . 0.0 110.982 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.622 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 20.3 p90 -129.65 176.7 7.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.835 1.254 . . . . 0.0 108.688 174.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -133.54 150.35 51.67 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.768 0.318 . . . . 0.0 110.174 174.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.506 ' ND2' ' HE3' ' A' ' 87' ' ' LYS . 3.4 p-10 -133.41 124.08 26.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.52 129.23 34.88 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 123.816 0.847 . . . . 0.0 109.614 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.506 ' HE3' ' ND2' ' A' ' 85' ' ' ASN . 34.2 mmtp -99.82 162.01 13.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.298 1.039 . . . . 0.0 111.355 -178.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.43 179.52 4.25 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.183 -1.372 . . . . 0.0 109.413 173.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.36 -15.63 63.35 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.06 0.544 . . . . 0.0 111.128 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -96.9 16.49 19.2 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.661 0.784 . . . . 0.0 111.968 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 80.6 m80 64.24 9.5 4.86 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 124.433 1.093 . . . . 0.0 112.723 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -88.04 146.47 25.45 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.248 0.619 . . . . 0.0 110.508 -176.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.4 mt -82.88 100.57 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.9 pt -86.98 -13.1 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.829 177.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.466 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -153.11 149.83 21.47 Favored Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 176.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 p -158.32 128.54 6.07 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.479 0.711 . . . . 0.0 109.502 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.7 t -107.37 166.97 10.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.688 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -75.03 161.24 29.62 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.508 0.723 . . . . 0.0 110.724 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.622 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -74.7 118.67 17.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.381 0.61 . . . . 0.0 110.005 -178.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.51 148.44 27.21 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.316 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.33 71.79 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.956 0.902 . . . . 0.0 112.117 -177.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.3 p -128.94 162.68 27.0 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.483 0.713 . . . . 0.0 110.188 175.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -65.5 -36.09 82.81 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.139 172.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.0 -37.91 89.06 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.489 0.715 . . . . 0.0 111.503 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.0 t -67.92 -30.58 69.94 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.57 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -70.59 -38.21 74.0 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.865 0.466 . . . . 0.0 110.704 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 7.1 mm-40 -68.09 -28.9 67.74 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.127 0.571 . . . . 0.0 111.011 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.2 m -61.72 -45.95 91.75 Favored 'General case' 0 C--N 1.349 0.577 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.07 -34.84 91.01 Favored Glycine 0 C--N 1.349 1.285 0 CA-C-N 115.056 -0.974 . . . . 0.0 113.526 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 28.6 mm -60.05 -52.37 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.1 66.44 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.473 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.1 t -70.72 -50.07 40.2 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.248 0.619 . . . . 0.0 110.003 -178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.55 -30.67 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 C-N-CA 123.504 0.721 . . . . 0.0 110.871 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 83.9 tttt -64.2 -35.02 79.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.432 0.693 . . . . 0.0 111.45 177.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -93.49 -36.17 12.58 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.663 0.785 . . . . 0.0 112.49 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -103.76 -8.56 19.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.096 0.958 . . . . 0.0 111.785 -168.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.61 -22.79 73.61 Favored Glycine 0 N--CA 1.472 1.041 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.131 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -84.06 -12.12 55.63 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.662 0.785 . . . . 0.0 111.354 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.8 m -69.42 101.59 1.59 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 109.888 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -82.86 18.95 1.45 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.272 0.629 . . . . 0.0 111.915 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.6 m -75.32 93.95 2.96 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.298 1.039 . . . . 0.0 109.353 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.62 139.32 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.662 0.785 . . . . 0.0 110.903 -172.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.545 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -118.91 115.36 24.21 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.351 1.06 . . . . 0.0 109.099 175.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.38 97.35 7.68 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 121.421 0.629 . . . . 0.0 111.142 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.59 -16.01 58.87 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.179 0.992 . . . . 0.0 111.312 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 CA--C 1.547 0.857 0 C-N-CA 124.553 1.141 . . . . 0.0 112.459 -175.629 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.265 0 N-CA-C 113.526 0.17 . . . . 0.0 113.526 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 38.3 p90 -119.51 160.3 22.66 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.916 0.887 . . . . 0.0 110.597 -173.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -86.95 153.31 21.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.976 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.436 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 86.6 mt-10 -132.86 121.21 22.57 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 167.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.28 98.16 5.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -99.33 163.04 12.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.84 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 17.2 ptpt -133.83 134.12 42.42 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 168.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.9 m -76.62 175.47 9.27 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.319 0.581 . . . . 0.0 110.896 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 t -67.5 -12.58 60.65 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.619 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -83.37 3.59 31.08 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.658 1.183 . . . . 0.0 112.219 175.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 m120 65.67 15.32 9.99 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.167 0.987 . . . . 0.0 111.923 -175.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -96.29 137.76 34.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.864 0.865 . . . . 0.0 109.914 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -90.55 144.22 25.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.034 0.534 . . . . 0.0 110.73 -175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -156.97 147.04 20.96 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 109.064 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -94.28 127.5 40.18 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.3 m -107.47 132.8 54.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 116' ' ' ASN . 11.5 mt -99.24 112.24 24.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.395 0.678 . . . . 0.0 109.257 177.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -102.75 125.94 49.68 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.98 178.05 1.2 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 123.758 0.661 . . . . 0.0 111.097 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.91 -12.75 37.34 Favored Glycine 0 CA--C 1.541 1.685 0 N-CA-C 114.079 0.392 . . . . 0.0 114.079 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -85.2 -6.22 59.29 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.411 1.085 . . . . 0.0 112.017 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 14.32 81.9 Favored Glycine 0 N--CA 1.473 1.121 0 C-N-CA 122.727 0.204 . . . . 0.0 112.982 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -102.75 121.5 42.59 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.328 1.051 . . . . 0.0 109.764 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.1 m -66.21 120.97 14.17 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.074 0.55 . . . . 0.0 110.459 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.2 pt -99.93 -35.41 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 124.616 1.166 . . . . 0.0 110.366 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 20.4 tp -137.38 148.47 46.25 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.701 0.801 . . . . 0.0 109.926 -169.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.1 m -145.15 116.81 8.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.32 0.648 . . . . 0.0 109.506 175.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.5 t -65.44 157.72 28.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.087 0.955 . . . . 0.0 110.801 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.84 164.83 18.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.126 0.571 . . . . 0.0 111.153 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.65 127.92 34.33 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.167 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -107.7 142.68 37.32 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.119 0.968 . . . . 0.0 109.706 177.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.3 -22.5 63.79 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.368 0.667 . . . . 0.0 111.749 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.7 t -148.42 159.5 43.97 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.237 0.615 . . . . 0.0 111.483 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -27.96 68.3 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.786 0.835 . . . . 0.0 111.177 176.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.9 t -71.27 -32.51 68.79 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.912 0.485 . . . . 0.0 110.731 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 16.4 m -69.04 -40.87 78.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.492 0.717 . . . . 0.0 109.61 173.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.98 -31.67 72.39 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.355 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.83 -40.33 95.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.546 0.739 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -71.3 -34.37 70.55 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.525 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.45 98.29 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.637 -0.711 . . . . 0.0 113.14 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.498 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.6 tt -74.68 -37.73 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.741 0.27 . . . . 0.0 110.742 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.62 70.47 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.059 0.544 . . . . 0.0 110.267 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 m -71.53 -55.71 7.29 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.708 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.498 HG22 ' HA ' ' A' ' 59' ' ' ILE . 33.7 m -59.61 -31.2 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-N 118.27 0.486 . . . . 0.0 111.758 -176.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -62.5 -47.85 82.12 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.54 1.136 . . . . 0.0 110.546 176.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.3 m -72.26 -26.1 61.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.025 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.484 ' ND2' ' HG2' ' A' ' 71' ' ' ARG . 4.3 m-20 -96.39 1.59 51.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.326 1.051 . . . . 0.0 111.794 -174.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.539 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 23.5 m -59.46 -50.27 88.08 Favored Pre-proline 0 CA--C 1.565 1.525 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.777 175.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -83.03 -5.78 11.29 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.824 1.682 . . . . 0.0 113.232 175.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -83.32 78.35 9.64 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.62 -30.22 71.36 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.925 0.89 . . . . 0.0 112.055 -175.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.18 -24.45 59.37 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.626 0.77 . . . . 0.0 111.195 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.484 ' HG2' ' ND2' ' A' ' 65' ' ' ASN . 3.4 tpm_? -75.79 -23.25 55.87 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.196 0.599 . . . . 0.0 110.661 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -70.55 120.56 16.36 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -101.36 108.3 19.88 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.482 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 135.58 33.49 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.665 0.386 . . . . 0.0 110.093 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -155.59 161.43 40.84 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 109.747 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.9 m -92.56 141.55 28.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.05 0.54 . . . . 0.0 109.814 176.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.69 158.0 28.45 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.712 0.805 . . . . 0.0 109.943 170.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.9 t -64.06 -23.79 67.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.307 0.643 . . . . 0.0 110.714 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -66.9 -18.44 65.38 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.876 0.871 . . . . 0.0 111.693 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.88 -7.9 42.12 Favored Glycine 0 C--N 1.349 1.271 0 C-N-CA 122.961 0.315 . . . . 0.0 113.591 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.524 ' HG3' ' HA ' ' A' ' 101' ' ' ALA . 0.0 OUTLIER -99.31 146.18 26.52 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.18 0.592 . . . . 0.0 110.734 -176.367 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -90.43 139.19 30.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.155 0.982 . . . . 0.0 110.415 -172.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -148.64 174.86 11.71 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.674 0.79 . . . . 0.0 109.268 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -131.14 138.74 49.6 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.458 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.515 HD21 HD11 ' A' ' 93' ' ' ILE . 11.5 m-20 -114.9 105.56 13.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.892 1.277 . . . . 0.0 108.904 172.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.505 HD23 HD13 ' A' ' 94' ' ' ILE . 0.7 OUTLIER -78.7 111.6 14.96 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 173.216 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -120.73 146.18 46.74 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 176.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB1' HD11 ' A' ' 94' ' ' ILE . . . -86.44 -173.88 4.74 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.443 0.697 . . . . 0.0 111.13 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.35 -28.1 67.91 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -95.9 24.42 5.49 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.096 0.558 . . . . 0.0 111.571 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.0 t60 72.3 -3.79 2.19 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -70.61 112.63 7.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.381 0.672 . . . . 0.0 109.93 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.515 HD11 HD21 ' A' ' 85' ' ' ASN . 57.0 mt -67.39 98.35 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 122.032 0.92 . . . . 0.0 109.071 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.505 HD13 HD23 ' A' ' 86' ' ' LEU . 21.3 pt -82.67 -6.68 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.144 -178.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -164.03 117.24 0.75 Allowed Glycine 0 C--N 1.345 1.034 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.5 t -116.12 114.86 25.07 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.903 0.881 . . . . 0.0 108.944 175.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.9 p -81.79 167.76 18.72 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.842 0.457 . . . . 0.0 111.283 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -77.23 164.31 25.72 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.226 177.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.8 ptp -73.58 123.5 24.1 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -102.31 122.08 43.54 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.77 0.828 . . . . 0.0 109.773 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.524 ' HA ' ' HG3' ' A' ' 81' ' ' LYS . . . -62.79 -40.72 98.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.816 0.846 . . . . 0.0 110.845 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.469 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 39.1 p -104.87 131.3 52.53 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.21 65.35 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.306 1.042 . . . . 0.0 111.828 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.469 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 10.8 pt20 -62.93 -37.43 87.0 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.024 0.53 . . . . 0.0 110.737 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 13.9 t -71.31 -28.53 64.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.383 0.673 . . . . 0.0 110.515 -177.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -67.36 -51.2 55.1 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.105 0.962 . . . . 0.0 109.87 177.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.96 -29.09 60.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.095 0.558 . . . . 0.0 111.948 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 98.0 m -67.57 -33.51 75.17 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.2 -30.12 76.56 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.171 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.3 mm -64.96 -49.39 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-O 121.368 0.604 . . . . 0.0 109.886 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.91 73.08 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.198 178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.2 t -71.13 -48.65 50.89 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.16 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.19 -27.12 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.448 0.699 . . . . 0.0 110.724 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.539 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 38.8 ttpt -66.59 -46.75 74.92 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 172.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.58 -33.66 69.24 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.906 0.883 . . . . 0.0 111.92 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.609 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -84.39 -30.99 24.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 0.0 110.01 -177.158 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.54 -41.17 58.27 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.5 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.1 p -80.47 -4.71 54.84 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.446 0.698 . . . . 0.0 111.713 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.8 t -75.77 -34.33 60.24 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.992 0.517 . . . . 0.0 109.835 173.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 67.75 -7.64 0.58 Allowed 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 125.37 1.468 . . . . 0.0 114.261 167.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 t -80.31 123.98 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.229 0.612 . . . . 0.0 110.768 -170.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 57.6 t -105.52 133.95 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 123.35 0.66 . . . . 0.0 111.303 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.436 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 43.1 tptt -110.45 141.76 43.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.11 1.364 . . . . 0.0 108.411 173.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -84.24 112.4 20.25 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -110.7 11.59 22.67 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.891 0.853 . . . . 0.0 109.687 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.447 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 21.7 p . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 124.255 1.022 . . . . 0.0 110.82 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.522 0.487 0 N-CA-C 114.011 0.364 . . . . 0.0 114.011 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -152.2 169.87 21.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.844 0.858 . . . . 0.0 109.958 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -109.98 127.15 54.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.347 1.059 . . . . 0.0 109.568 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -91.97 106.87 18.8 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 167.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 64.6 tp -85.52 98.5 10.66 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -113.37 177.92 4.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.937 0.895 . . . . 0.0 109.735 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -141.75 156.0 45.61 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.626 0.77 . . . . 0.0 109.935 175.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.6 m -89.86 178.69 6.17 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.126 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -66.65 -22.85 66.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.616 0.766 . . . . 0.0 110.801 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -91.11 15.36 11.86 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.415 0.686 . . . . 0.0 111.285 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 67.3 14.96 9.87 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.243 1.417 . . . . 0.0 112.75 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 16.0 mm100 -70.32 124.86 25.2 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.67 0.788 . . . . 0.0 110.997 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.84 118.68 24.64 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.809 0.844 . . . . 0.0 108.942 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -142.49 118.99 10.95 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.92 0.888 . . . . 0.0 109.093 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -94.04 132.03 38.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.571 HG12 HG22 ' A' ' 45' ' ' THR . 23.2 m -107.45 133.97 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 171.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.9 tp -90.0 120.79 31.51 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -106.8 153.95 21.72 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.692 1.197 . . . . 0.0 109.653 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.19 177.66 8.88 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.775 168.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.34 -23.53 62.43 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.449 173.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -67.35 -18.89 65.33 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.766 1.227 . . . . 0.0 111.769 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.89 -7.82 80.66 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.796 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.05 136.23 36.53 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.286 0.634 . . . . 0.0 109.712 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.0 m -73.15 120.84 19.33 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.342 0.591 . . . . 0.0 109.779 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.541 HD11 ' HG ' ' A' ' 35' ' ' LEU . 22.0 pt -103.74 -16.52 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.606 1.162 . . . . 0.0 111.245 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.7 tp -157.8 141.7 15.79 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -176.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.571 HG22 HG12 ' A' ' 34' ' ' VAL . 53.3 m -133.16 113.45 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.242 0.617 . . . . 0.0 109.652 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -69.5 164.82 22.3 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.964 0.506 . . . . 0.0 110.799 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -75.92 166.01 24.14 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.399 0.619 . . . . 0.0 111.601 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.86 114.18 15.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.642 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -100.37 145.57 28.02 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.587 0.755 . . . . 0.0 109.17 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -90.15 -2.13 58.03 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 120.988 0.423 . . . . 0.0 111.099 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.409 ' HB3' HG22 ' A' ' 53' ' ' THR . 50.8 m -142.03 137.25 30.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.507 0.723 . . . . 0.0 110.549 -177.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -28.24 69.78 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.939 0.895 . . . . 0.0 111.64 178.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.409 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -63.22 -33.72 76.11 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.459 0.704 . . . . 0.0 111.156 178.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 m -76.56 -31.65 57.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.632 0.773 . . . . 0.0 110.466 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.19 -32.39 66.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.507 0.723 . . . . 0.0 110.752 173.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -67.4 -49.11 65.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.959 0.904 . . . . 0.0 110.37 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.63 -36.57 84.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.617 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.6 -48.51 85.84 Favored Glycine 0 C--N 1.345 1.049 0 O-C-N 124.124 0.89 . . . . 0.0 112.563 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.512 ' HA ' HG22 ' A' ' 62' ' ' VAL . 15.9 tt -74.64 -31.48 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 116.608 0.204 . . . . 0.0 111.146 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.68 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.972 0.509 . . . . 0.0 110.331 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.0 m -73.37 -47.71 40.0 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.13 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.512 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -62.3 -35.29 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 118.654 0.661 . . . . 0.0 110.741 -177.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.697 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 12.2 ttp180 -66.25 -45.52 80.31 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.173 0.989 . . . . 0.0 110.357 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -67.92 -28.37 67.43 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.784 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.445 ' HB3' HD13 ' A' ' 86' ' ' LEU . 16.0 m120 -100.94 3.53 41.77 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.135 0.974 . . . . 0.0 111.777 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.0 m -63.11 -52.25 63.92 Favored Pre-proline 0 CA--C 1.56 1.346 0 CA-C-O 118.648 -0.691 . . . . 0.0 110.831 172.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.49 -19.46 42.82 Favored 'Trans proline' 0 C--N 1.4 3.238 0 C-N-CA 121.642 1.561 . . . . 0.0 111.65 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 -81.73 77.21 8.6 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 121.944 0.878 . . . . 0.0 109.542 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -66.95 -21.17 65.99 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.166 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -74.43 -31.69 62.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.717 0.807 . . . . 0.0 110.603 174.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -76.51 -25.5 54.25 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.324 0.65 . . . . 0.0 111.74 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.643 ' HE1' HG22 ' A' ' 110' ' ' ILE . 8.3 p90 -107.53 132.96 52.68 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 121.133 0.492 . . . . 0.0 110.407 172.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -97.31 117.11 30.79 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.064 -174.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.465 ' HB3' HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -71.77 104.08 3.31 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.214 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -119.71 151.73 38.29 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.23 1.012 . . . . 0.0 110.6 -169.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.0 m -106.17 124.64 49.91 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.351 0.66 . . . . 0.0 109.755 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 166.24 16.83 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.487 1.115 . . . . 0.0 112.046 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.9 p -64.87 -16.9 63.78 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.06 0.944 . . . . 0.0 112.112 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -90.36 9.71 27.86 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.056 0.943 . . . . 0.0 110.999 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.44 6.85 71.62 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 123.026 0.345 . . . . 0.0 113.758 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 48.2 mmtm -88.98 152.26 21.81 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.069 0.948 . . . . 0.0 110.499 -177.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.409 ' HB3' ' HB2' ' A' ' 106' ' ' ARG . 89.4 m-85 -109.74 126.52 53.82 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.378 0.671 . . . . 0.0 111.017 -170.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.681 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 16.5 p90 -143.97 178.85 7.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.68 1.192 . . . . 0.0 108.538 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.506 ' HE2' HG22 ' A' ' 113' ' ' VAL . 19.6 p90 -146.26 135.08 22.38 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.6 p-10 -116.04 146.12 42.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 65' ' ' ASN . 25.3 tp -119.08 120.35 36.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.667 0.787 . . . . 0.0 109.982 -173.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -91.89 149.96 21.29 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.487 1.115 . . . . 0.0 110.985 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -107.69 176.15 5.25 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.354 1.062 . . . . 0.0 109.554 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.55 -28.2 66.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.56 0.744 . . . . 0.0 111.632 175.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -81.41 5.88 16.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.6 m80 66.24 13.12 9.01 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.685 1.194 . . . . 0.0 111.916 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.77 153.42 17.77 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 124.042 0.937 . . . . 0.0 109.874 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.5 mm -81.85 119.02 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.2 pt -98.17 -8.98 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.187 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.92 111.36 0.33 Allowed Glycine 0 C--N 1.347 1.159 0 O-C-N 123.452 0.47 . . . . 0.0 112.344 175.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 p -114.91 131.6 56.82 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.1 t -85.97 158.19 19.94 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 123.175 0.59 . . . . 0.0 110.261 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -78.41 149.08 33.39 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.681 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.0 ptt? -74.06 117.32 15.72 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.23 0.538 . . . . 0.0 110.662 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -89.45 160.08 16.96 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.602 1.161 . . . . 0.0 111.283 -176.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.437 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -75.84 -52.44 10.36 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.063 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 67.9 p -85.37 142.77 29.06 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.467 -171.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.48 -25.77 64.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.949 0.9 . . . . 0.0 111.191 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -68.56 -36.36 78.66 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 122.98 0.512 . . . . 0.0 110.505 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.2 t -67.96 -23.2 65.02 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.858 0.863 . . . . 0.0 111.309 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.46 ' O ' HG12 ' A' ' 110' ' ' ILE . 55.7 ttp180 -61.28 -56.84 15.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.365 0.666 . . . . 0.0 109.547 172.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -72.94 -32.97 65.64 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.901 0.88 . . . . 0.0 111.753 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.9 m -67.28 -36.09 80.85 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.42 -35.84 63.15 Favored Glycine 0 C--N 1.347 1.187 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.04 176.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.643 HG22 ' HE1' ' A' ' 72' ' ' TYR . 45.4 mm -57.06 -46.9 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.4 0.68 . . . . 0.0 109.419 172.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.95 -37.06 78.62 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.232 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t -67.26 -51.92 47.1 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.059 -174.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.506 HG22 ' HE2' ' A' ' 84' ' ' PHE . 79.6 t -64.9 -31.98 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 123.24 0.616 . . . . 0.0 111.27 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.87 -39.38 94.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.502 0.721 . . . . 0.0 112.026 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -92.51 -43.82 8.96 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.313 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.488 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 59.6 m-20 -83.98 -18.94 35.5 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.997 0.919 . . . . 0.0 111.746 -171.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.8 -27.75 64.25 Favored Glycine 0 C--N 1.341 0.808 0 O-C-N 123.168 0.292 . . . . 0.0 112.886 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.697 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 48.1 p -75.17 -7.83 54.9 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 87.7 p -68.98 -44.22 73.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.379 0.672 . . . . 0.0 111.308 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.452 ' HB2' ' HD3' ' A' ' 63' ' ' ARG . 43.6 tt0 61.9 13.78 5.82 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.028 1.331 . . . . 0.0 111.947 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 m -81.46 89.2 6.13 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.672 -0.643 . . . . 0.0 111.107 -169.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 10.4 m -85.48 112.3 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-O 121.601 0.715 . . . . 0.0 111.728 -176.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -83.03 102.78 11.99 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 164.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.41 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 10.1 p-10 -72.04 95.31 1.59 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.464 1.126 . . . . 0.0 109.826 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -90.7 6.31 44.55 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.604 176.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 p . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 124.592 1.157 . . . . 0.0 110.817 173.625 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.446 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.525 0.708 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -159.75 164.67 33.64 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.913 0.885 . . . . 0.0 110.272 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -104.47 154.41 19.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.024 0.93 . . . . 0.0 109.643 172.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.508 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.8 mt-10 -136.39 117.89 14.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.084 0.954 . . . . 0.0 109.238 169.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.539 HD22 ' HB2' ' A' ' 52' ' ' LYS . 64.2 tp -81.0 107.1 13.52 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 175.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.9 p -126.85 136.66 52.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.502 0.721 . . . . 0.0 110.946 -170.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -94.66 137.71 33.42 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.696 0.798 . . . . 0.0 108.855 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -93.91 -176.51 4.05 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.766 0.826 . . . . 0.0 111.432 -177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -67.6 -16.33 64.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.029 0.532 . . . . 0.0 110.559 174.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -68.85 -12.78 61.91 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.161 0.984 . . . . 0.0 112.072 174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 69.87 13.26 8.0 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.603 1.161 . . . . 0.0 110.493 -171.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.519 ' HB2' HD11 ' A' ' 48' ' ' LEU . 14.7 mm-40 -108.22 150.62 27.03 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.111 0.964 . . . . 0.0 110.123 -176.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -100.88 128.92 46.71 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.027 0.931 . . . . 0.0 110.585 -169.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.0 ptt85 -143.79 139.63 29.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.617 0.767 . . . . 0.0 109.056 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -94.97 137.09 34.48 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.87 132.33 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 175.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -97.97 114.94 27.19 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -103.69 153.16 20.97 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.597 1.159 . . . . 0.0 110.375 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.8 -175.36 4.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.318 1.047 . . . . 0.0 110.234 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.56 -29.77 72.76 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 113.96 0.344 . . . . 0.0 113.96 -178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -72.58 -21.32 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.026 0.93 . . . . 0.0 111.086 176.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 7.5 59.5 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.204 -173.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -81.39 121.84 26.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.627 0.771 . . . . 0.0 109.748 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 m -70.08 121.64 17.86 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 122.914 0.485 . . . . 0.0 109.905 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.8 pt -100.06 -23.43 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.892 1.277 . . . . 0.0 110.74 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 18.8 tp -145.55 139.64 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.59 0.756 . . . . 0.0 109.574 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.3 m -135.91 125.2 24.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.508 0.723 . . . . 0.0 109.158 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -78.85 170.31 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.554 0.342 . . . . 0.0 110.99 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -74.38 161.64 29.65 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.522 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 30' ' ' GLN . 3.8 mm? -68.75 111.6 4.96 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.038 174.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.401 ' OH ' ' HA ' ' A' ' 94' ' ' ILE . 79.3 m-85 -98.1 151.08 20.75 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.869 0.867 . . . . 0.0 109.992 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.35 -22.47 63.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.357 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.3 t -142.54 153.2 43.36 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.382 0.673 . . . . 0.0 110.705 -176.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.539 ' HB2' HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -69.27 -27.22 65.23 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.654 175.451 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.7 p -60.81 -40.28 92.15 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.824 0.703 . . . . 0.0 110.659 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -65.43 -33.83 76.88 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.241 1.016 . . . . 0.0 111.347 177.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.24 -29.18 60.16 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.218 0.607 . . . . 0.0 111.402 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -74.32 -33.51 63.2 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.624 0.77 . . . . 0.0 110.24 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.5 -34.22 75.51 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.477 169.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -49.87 73.86 Favored Glycine 0 C--N 1.349 1.271 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.714 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.491 ' HA ' HG22 ' A' ' 62' ' ' VAL . 8.0 tt -69.07 -35.56 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 117.037 0.419 . . . . 0.0 110.903 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -36.29 74.66 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.211 0.529 . . . . 0.0 110.289 175.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.9 m -75.76 -44.43 41.63 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.593 177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.491 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.9 m -62.95 -32.42 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-N 119.381 0.991 . . . . 0.0 110.299 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.784 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -68.03 -50.58 54.47 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.383 1.073 . . . . 0.0 109.084 177.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.2 t -63.75 -31.52 72.73 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.093 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -107.5 16.57 23.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.133 0.973 . . . . 0.0 111.898 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -60.13 -52.68 71.64 Favored Pre-proline 0 CA--C 1.566 1.573 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.041 169.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -77.31 -6.13 16.2 Favored 'Trans proline' 0 C--N 1.399 3.226 0 C-N-CA 121.91 1.74 . . . . 0.0 112.435 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -96.22 82.33 3.43 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.69 -24.24 67.54 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.881 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -59.66 -29.99 68.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.885 0.874 . . . . 0.0 111.41 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -24.04 53.78 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.197 0.599 . . . . 0.0 111.384 -175.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -80.41 105.54 11.74 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -96.8 108.9 21.65 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.14 0.576 . . . . 0.0 109.856 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -78.26 117.55 19.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.387 0.675 . . . . 0.0 109.888 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -119.73 142.29 48.66 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.98 0.912 . . . . 0.0 110.398 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.4 m -94.76 111.29 23.08 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.22 154.62 12.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.236 1.014 . . . . 0.0 112.057 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.1 t -63.0 -17.45 62.18 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.024 0.93 . . . . 0.0 111.164 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.38 3.99 11.92 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.709 1.203 . . . . 0.0 111.839 174.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.77 0.06 87.31 Favored Glycine 0 C--N 1.354 1.535 0 C-N-CA 123.276 0.465 . . . . 0.0 112.778 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -87.73 165.29 15.47 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.029 0.931 . . . . 0.0 111.266 -172.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -113.82 129.17 56.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.366 0.666 . . . . 0.0 110.103 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -143.63 176.51 9.16 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.5 p90 -141.87 138.07 31.86 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 122.745 0.418 . . . . 0.0 110.212 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -99.31 166.94 10.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 169.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.613 HD22 HD13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -135.1 121.3 20.15 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 -176.255 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -95.53 173.61 7.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.268 0.627 . . . . 0.0 111.864 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -135.87 174.28 10.79 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.67 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.26 -28.4 69.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.021 0.928 . . . . 0.0 111.386 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -85.97 6.9 26.57 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.556 0.742 . . . . 0.0 111.139 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 69.75 7.21 6.11 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.533 1.133 . . . . 0.0 111.606 -178.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.85 143.1 30.13 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.429 0.692 . . . . 0.0 110.678 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.8 mt -80.5 109.93 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.613 HD13 HD22 ' A' ' 86' ' ' LEU . 23.8 pt -91.42 -1.61 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 124.059 0.944 . . . . 0.0 112.26 -177.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.42 147.76 9.41 Favored Glycine 0 C--O 1.221 -0.695 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.6 p -154.81 129.07 8.98 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.675 0.79 . . . . 0.0 109.198 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.4 t -81.89 161.65 23.06 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -83.78 -78.43 0.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.796 0.438 . . . . 0.0 110.5 -171.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -168.22 121.67 0.89 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.225 0.61 . . . . 0.0 109.806 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -104.02 127.63 51.58 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.598 0.759 . . . . 0.0 109.68 173.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.37 -57.12 7.18 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.223 0.609 . . . . 0.0 109.702 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.499 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 38.8 p -85.5 125.57 33.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.703 174.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.7 -16.1 63.97 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.595 0.758 . . . . 0.0 112.276 -176.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.499 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 12.7 pt20 -65.17 -31.22 72.29 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.438 0.695 . . . . 0.0 110.977 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 m -72.79 -23.38 60.79 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.649 0.78 . . . . 0.0 111.085 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.415 ' O ' HG12 ' A' ' 110' ' ' ILE . 6.3 tmm_? -71.85 -40.72 68.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.66 0.784 . . . . 0.0 108.97 173.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.53 -50.49 71.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.805 0.842 . . . . 0.0 110.596 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.8 m -65.49 -29.97 70.68 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.208 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.9 -44.79 95.54 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.402 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 106' ' ' ARG . 37.3 mm -56.43 -49.18 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.401 0.68 . . . . 0.0 109.791 176.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.43 -36.25 82.34 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.793 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -72.1 -42.21 66.39 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.693 0.797 . . . . 0.0 110.52 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 71.0 t -70.19 -32.8 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.605 0.762 . . . . 0.0 110.76 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -67.46 -43.14 81.81 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.114 0.565 . . . . 0.0 110.572 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.15 -45.37 66.93 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.929 0.892 . . . . 0.0 111.47 -177.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.446 ' ND2' ' HA3' ' A' ' 19' ' ' GLY . 22.4 m120 -93.88 -1.85 54.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.2 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.62 -29.62 65.37 Favored Glycine 0 C--N 1.343 0.922 0 N-CA-C 111.996 -0.441 . . . . 0.0 111.996 174.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.784 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 14.7 t -88.63 5.71 41.71 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.803 0.841 . . . . 0.0 111.664 177.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.4 m -82.59 109.28 16.64 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.109 0.564 . . . . 0.0 109.695 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -86.5 74.63 9.88 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 122.031 0.92 . . . . 0.0 108.781 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.0 m -147.12 94.72 2.45 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.094 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 m -105.28 140.32 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.508 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 28.9 mtmm -107.76 117.63 34.62 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 170.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.83 94.59 1.06 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 175.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.42 -18.8 40.6 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.678 178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.549 0.937 0 C-N-CA 124.335 1.054 . . . . 0.0 110.827 174.865 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.569 0 N-CA-C 111.99 -0.444 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -130.94 151.32 51.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.526 0.73 . . . . 0.0 110.742 -175.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -90.26 155.02 19.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.543 168.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.559 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 41.3 mt-10 -132.46 124.5 28.7 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.504 HD12 ' HB3' ' A' ' 31' ' ' PHE . 37.4 tp -79.7 99.5 7.44 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 p -106.57 156.85 18.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.28 1.432 . . . . 0.0 109.139 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HB3' HG21 ' A' ' 126' ' ' THR . 21.6 ptmt -118.31 160.81 20.98 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.511 0.725 . . . . 0.0 109.869 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.3 t -120.39 177.81 4.89 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.457 0.703 . . . . 0.0 109.457 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -71.68 -8.52 54.65 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.142 0.577 . . . . 0.0 111.1 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.73 -4.2 33.06 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.201 1.0 . . . . 0.0 111.589 170.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 40.2 t-20 77.69 -12.94 1.01 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 125.614 1.565 . . . . 0.0 110.724 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -83.5 156.62 22.75 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.218 1.007 . . . . 0.0 112.111 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.504 ' HB3' HD12 ' A' ' 23' ' ' LEU . 27.0 m-85 -97.7 151.55 20.02 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.172 -175.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -156.95 155.88 32.08 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.627 0.771 . . . . 0.0 109.442 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -102.3 131.53 48.82 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.017 0.527 . . . . 0.0 109.767 173.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.56 130.55 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.37 108.75 21.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -177.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -97.87 130.69 44.76 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.84 178.06 1.47 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.182 0.593 . . . . 0.0 110.806 172.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.58 -18.14 55.41 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-O 121.025 0.236 . . . . 0.0 113.261 174.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -74.21 -14.38 60.93 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 111.578 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.35 12.75 80.08 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.649 -172.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -98.38 124.31 42.98 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.529 0.732 . . . . 0.0 110.568 -175.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.6 m -70.48 121.51 17.91 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.409 HD13 ' HG ' ' A' ' 112' ' ' SER . 25.1 pt -109.44 -34.75 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.038 0.935 . . . . 0.0 110.499 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.7 tp -137.02 151.2 48.69 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -145.98 112.99 6.1 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.414 0.686 . . . . 0.0 110.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.4 m -58.39 156.18 10.65 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.983 0.913 . . . . 0.0 111.178 173.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.453 ' CG ' ' HB ' ' A' ' 93' ' ' ILE . 23.1 mm-40 -66.91 169.22 8.5 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.266 0.555 . . . . 0.0 111.917 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.34 111.95 11.14 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.612 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.46 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 63.8 m-85 -104.7 132.92 50.37 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.58 1.552 . . . . 0.0 109.31 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.6 p -62.07 -34.73 76.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.145 0.978 . . . . 0.0 111.589 -175.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m -122.45 152.82 39.88 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.57 1.148 . . . . 0.0 109.563 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -27.3 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.809 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.8 t -72.09 -28.23 63.16 Favored 'General case' 0 C--N 1.36 1.048 0 O-C-N 123.56 0.538 . . . . 0.0 111.35 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.46 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.3 m -71.38 -33.07 69.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.424 0.63 . . . . 0.0 109.79 174.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.21 -34.24 59.26 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.649 172.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -67.4 -42.69 82.9 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.423 1.089 . . . . 0.0 110.918 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.085 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.68 -49.84 74.17 Favored Glycine 0 C--N 1.356 1.662 0 O-C-N 123.987 0.805 . . . . 0.0 112.695 177.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.404 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.3 tt -70.23 -35.86 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 122.196 0.198 . . . . 0.0 111.066 177.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.64 75.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.856 0.462 . . . . 0.0 110.746 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.9 m -76.0 -41.4 51.25 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.858 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.4 m -66.03 -30.82 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-N 119.028 0.831 . . . . 0.0 110.355 178.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -64.07 -39.63 94.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.139 1.375 . . . . 0.0 111.091 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 t -89.25 -28.49 19.89 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.315 0.646 . . . . 0.0 111.314 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -97.22 3.39 51.44 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.181 0.592 . . . . 0.0 112.076 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.627 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 11.7 p -69.43 -40.66 15.1 Favored Pre-proline 0 CA--C 1.568 1.66 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.854 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.48 -39.32 28.98 Favored 'Trans proline' 0 C--N 1.402 3.347 0 CA-C-N 121.484 1.566 . . . . 0.0 111.384 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -79.97 80.52 6.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.928 0.891 . . . . 0.0 110.235 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 12.4 pt-20 -68.13 -8.17 36.09 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.314 0.578 . . . . 0.0 111.868 174.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.64 -35.82 22.53 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.949 1.7 . . . . 0.0 112.217 165.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -85.28 -8.72 58.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.554 0.742 . . . . 0.0 112.41 -172.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -88.15 123.37 32.73 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.827 0.851 . . . . 0.0 109.179 177.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.7 96.79 9.23 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 170.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -85.58 121.53 28.4 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.556 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -145.23 142.5 29.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.457 0.703 . . . . 0.0 109.983 -173.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.6 m -99.82 130.05 45.98 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.145 0.578 . . . . 0.0 109.527 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.25 170.27 10.55 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.68 1.192 . . . . 0.0 111.845 178.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 m -64.55 -30.06 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.717 0.807 . . . . 0.0 111.464 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -72.77 -11.69 60.71 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.331 0.653 . . . . 0.0 112.146 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.17 18.4 53.56 Favored Glycine 0 C--N 1.344 0.996 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.5 mmtp -84.88 121.82 28.29 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.309 0.644 . . . . 0.0 110.222 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.454 ' HB2' ' HB2' ' A' ' 100' ' ' TYR . 73.8 m-85 -80.76 133.96 35.74 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.431 0.692 . . . . 0.0 109.76 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -152.22 173.66 14.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.458 0.647 . . . . 0.0 110.202 173.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -147.16 142.57 27.46 Favored 'General case' 0 C--O 1.246 0.912 0 C-N-CA 124.89 1.276 . . . . 0.0 108.213 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -117.18 110.6 18.35 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 174.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.672 HD22 HD13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -77.9 128.03 33.3 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 178.759 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.565 ' HE2' HG12 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -113.55 145.45 41.21 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.788 0.835 . . . . 0.0 110.126 -171.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.79 170.64 10.25 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.958 0.903 . . . . 0.0 109.613 171.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.98 61.27 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.156 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.13 2.56 56.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.092 0.957 . . . . 0.0 111.512 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 67.8 17.58 9.74 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.797 1.239 . . . . 0.0 112.439 -175.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -79.34 126.65 31.08 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.565 HG12 ' HE2' ' A' ' 87' ' ' LYS . 39.8 mt -73.58 96.87 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.672 HD13 HD22 ' A' ' 86' ' ' LEU . 13.9 pt -79.95 -13.33 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.86 -175.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -158.73 129.91 2.38 Favored Glycine 0 C--O 1.218 -0.853 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 173.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.3 t -134.2 112.43 11.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.8 p -71.0 140.42 50.81 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -77.12 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 124.277 0.986 . . . . 0.0 110.11 -168.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.55 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 20.8 ptp -171.61 134.67 0.84 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.258 1.023 . . . . 0.0 108.732 168.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.454 ' HB2' ' HB2' ' A' ' 82' ' ' PHE . 24.0 m-85 -105.13 136.65 44.24 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.062 0.945 . . . . 0.0 110.258 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -92.33 -24.83 18.8 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.114 0.566 . . . . 0.0 110.618 174.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.444 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 74.0 p -115.07 132.53 56.57 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.66 0.784 . . . . 0.0 110.049 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.05 -20.28 29.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.578 0.751 . . . . 0.0 110.941 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.444 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 14.0 pt20 -67.23 -33.77 76.07 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.861 0.864 . . . . 0.0 111.886 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.501 ' HB2' ' NH1' ' A' ' 106' ' ' ARG . 20.6 m -72.88 -18.46 61.42 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.111 0.564 . . . . 0.0 111.71 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.501 ' NH1' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER -59.99 -26.93 66.44 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.342 1.057 . . . . 0.0 112.473 178.416 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.5 -49.4 77.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.521 0.728 . . . . 0.0 110.472 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.5 m -76.23 -35.02 59.21 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.852 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.45 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -64.57 -51.94 47.55 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.874 -173.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.3 mm -59.17 -41.65 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 123.919 0.888 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.11 90.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.107 0.563 . . . . 0.0 110.967 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.409 ' HG ' HD13 ' A' ' 43' ' ' ILE . 27.3 t -73.77 -30.26 62.67 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.43 0.692 . . . . 0.0 111.721 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 109' ' ' GLY . 79.5 t -74.22 -35.5 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 122.567 0.347 . . . . 0.0 110.102 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.627 ' HA ' ' HB2' ' A' ' 66' ' ' SER . 68.7 mttm -70.65 -48.1 56.63 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.474 0.31 . . . . 0.0 111.089 174.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.49 -51.14 31.05 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.59 0.756 . . . . 0.0 111.967 -174.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -95.92 -7.47 36.57 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.182 0.593 . . . . 0.0 111.483 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.27 -21.08 71.02 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.084 0.24 . . . . 0.0 112.873 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.9 p -81.74 -1.45 47.13 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.372 0.669 . . . . 0.0 111.748 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.2 m -75.25 135.48 40.97 Favored 'General case' 0 C--N 1.348 0.541 0 C-N-CA 122.711 0.404 . . . . 0.0 110.941 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -3.28 58.07 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.306 0.642 . . . . 0.0 110.47 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 35.3 m -65.86 101.93 0.71 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.215 1.006 . . . . 0.0 110.847 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 16.0 m -117.91 142.12 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.559 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 14.2 tmtt? -122.09 139.69 53.41 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.01 124.09 27.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.394 0.616 . . . . 0.0 111.659 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -132.63 -18.8 2.42 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.614 0.766 . . . . 0.0 109.944 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.517 HG21 ' HB3' ' A' ' 25' ' ' LYS . 8.4 p . . . . . 0 C--N 1.36 1.062 0 C-N-CA 124.659 1.184 . . . . 0.0 111.004 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.526 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . . . . . . 0 C--O 1.236 0.271 0 N-CA-C 113.326 0.09 . . . . 0.0 113.326 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 31.7 p90 -137.49 148.65 46.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.063 0.945 . . . . 0.0 110.058 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -91.67 147.23 23.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.208 1.003 . . . . 0.0 108.859 170.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.533 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 42.9 mt-10 -133.75 116.37 15.67 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.471 0.709 . . . . 0.0 109.446 175.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.545 HD12 ' HB3' ' A' ' 31' ' ' PHE . 32.6 tp -83.25 99.51 10.02 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.381 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.9 p -108.84 147.59 31.88 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.329 1.052 . . . . 0.0 109.31 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -95.78 143.69 26.8 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 173.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.5 p -86.73 -172.34 3.96 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.209 1.003 . . . . 0.0 111.159 -176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.27 -19.85 64.74 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 122.803 0.441 . . . . 0.0 110.437 171.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -84.11 -1.09 54.32 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.016 0.927 . . . . 0.0 111.948 174.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.5 t30 69.96 9.77 7.22 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 124.73 1.212 . . . . 0.0 110.702 -175.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -88.3 154.4 20.44 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.589 0.756 . . . . 0.0 111.448 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.545 ' HB3' HD12 ' A' ' 23' ' ' LEU . 94.4 m-85 -89.79 125.15 35.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.247 1.019 . . . . 0.0 110.568 -171.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -137.56 130.33 30.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.922 1.289 . . . . 0.0 108.936 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -91.3 132.48 36.12 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.138 0.575 . . . . 0.0 109.638 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.475 HG12 HG21 ' A' ' 45' ' ' THR . 25.8 m -113.71 131.05 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 167.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 26.0 tp -101.7 110.26 22.21 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 177.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 61.2 mttp -100.4 143.17 30.9 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.849 0.86 . . . . 0.0 108.89 172.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.26 173.44 4.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.209 0.604 . . . . 0.0 110.144 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.15 -19.04 61.16 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.638 -0.255 . . . . 0.0 112.992 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.04 -4.08 39.37 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.295 1.038 . . . . 0.0 112.362 175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.42 4.25 89.03 Favored Glycine 0 C--N 1.348 1.232 0 CA-C-O 120.891 0.162 . . . . 0.0 112.842 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -90.19 113.29 25.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.439 1.096 . . . . 0.0 109.24 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 22.1 m -61.84 129.52 41.34 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 122.837 0.455 . . . . 0.0 109.821 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.5 pt -115.8 -22.12 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 124.426 1.091 . . . . 0.0 110.581 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.4 tp -150.97 143.77 24.49 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.335 1.054 . . . . 0.0 108.319 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.475 HG21 HG12 ' A' ' 34' ' ' VAL . 96.3 m -139.55 112.15 7.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.6 0.76 . . . . 0.0 109.235 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.4 t -68.68 166.1 18.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.857 0.863 . . . . 0.0 110.542 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -89.27 -172.51 3.66 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.82 119.66 26.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.76 0.824 . . . . 0.0 110.984 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.418 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.0 m-85 -109.19 133.18 53.36 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.014 0.925 . . . . 0.0 108.95 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 70.3 p -61.04 -41.27 96.26 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.114 0.566 . . . . 0.0 110.972 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -119.73 148.48 43.36 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.321 1.048 . . . . 0.0 109.738 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 16.4 ptpt -68.31 -27.03 65.93 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.433 0.293 . . . . 0.0 110.948 177.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.1 p -55.71 -37.63 68.66 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.737 0.815 . . . . 0.0 111.311 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 12.6 m -70.29 -38.92 75.11 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.907 0.883 . . . . 0.0 110.448 174.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.59 -28.53 67.84 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.471 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 52' ' ' LYS . 67.3 mm-40 -68.35 -38.89 81.9 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.239 0.616 . . . . 0.0 109.916 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 -31.67 70.72 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.294 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.403 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -65.34 -49.15 62.69 Favored Glycine 0 C--N 1.344 0.99 0 O-C-N 123.975 0.797 . . . . 0.0 113.061 177.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.415 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.3 tt -72.52 -31.88 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 122.672 0.389 . . . . 0.0 110.977 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.9 85.4 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.673 0.389 . . . . 0.0 110.129 173.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.7 m -69.81 -47.15 63.88 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.836 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.415 HG21 ' HA ' ' A' ' 59' ' ' ILE . 15.1 m -61.79 -34.22 61.44 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 CA-C-N 119.146 0.885 . . . . 0.0 111.618 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.29 -33.41 49.44 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 123.299 0.639 . . . . 0.0 109.727 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.7 t -75.18 -26.29 58.93 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.823 0.849 . . . . 0.0 111.097 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.18 0.63 43.76 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.266 1.026 . . . . 0.0 110.993 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.7 t -67.34 -40.0 24.1 Favored Pre-proline 0 CA--C 1.566 1.576 0 C-N-CA 123.007 0.523 . . . . 0.0 111.837 175.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -72.38 -23.85 20.06 Favored 'Trans proline' 0 C--N 1.39 2.723 0 C-N-CA 121.756 1.637 . . . . 0.0 113.229 166.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -79.94 90.87 5.36 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.914 0.485 . . . . 0.0 110.356 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 72' ' ' TYR . 11.6 pt-20 -64.93 -24.17 67.44 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.015 0.926 . . . . 0.0 111.776 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.29 -14.47 62.61 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.978 0.911 . . . . 0.0 112.557 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.424 ' HA ' ' HE ' ' A' ' 71' ' ' ARG . 7.7 mmp_? -91.14 -24.04 20.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.769 0.428 . . . . 0.0 110.762 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.402 ' HD2' ' HA ' ' A' ' 69' ' ' GLU . 89.6 m-85 -75.46 95.78 3.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.614 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -96.12 106.18 18.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.705 0.802 . . . . 0.0 109.857 -174.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB3' ' NE ' ' A' ' 106' ' ' ARG . 62.4 pttt -91.19 123.41 34.62 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.185 0.517 . . . . 0.0 111.223 -177.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.63 168.97 16.25 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.738 0.815 . . . . 0.0 109.494 175.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 7.4 m -100.4 112.65 25.02 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.23 163.05 1.23 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.464 1.106 . . . . 0.0 112.284 174.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 80.7 p -62.52 -20.26 64.44 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.373 0.669 . . . . 0.0 111.318 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -81.38 2.58 27.83 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.852 1.261 . . . . 0.0 111.882 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.33 19.3 79.64 Favored Glycine 0 C--N 1.353 1.49 0 C-N-CA 122.973 0.32 . . . . 0.0 113.455 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 99' ' ' MET . 73.3 mmtt -106.81 155.79 19.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.581 0.752 . . . . 0.0 110.125 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -104.76 128.85 53.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.878 0.471 . . . . 0.0 109.834 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.552 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 2.0 p90 -148.84 174.34 12.32 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.561 ' HB3' ' HE ' ' A' ' 106' ' ' ARG . 43.8 p90 -130.19 136.12 48.9 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.026 0.53 . . . . 0.0 111.805 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -103.45 115.37 30.41 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 170.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 24.0 tp -80.1 113.62 18.41 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 173.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.437 ' HE2' HG12 ' A' ' 93' ' ' ILE . 35.1 mmtp -97.39 164.11 12.59 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.005 0.922 . . . . 0.0 111.226 -175.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.79 175.27 5.55 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.253 1.021 . . . . 0.0 110.861 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.93 -26.07 65.79 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.131 0.972 . . . . 0.0 111.101 175.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -88.11 12.03 14.67 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.878 0.871 . . . . 0.0 110.946 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 65.2 15.77 10.19 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.821 1.248 . . . . 0.0 112.335 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -82.45 151.14 26.68 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.447 0.699 . . . . 0.0 110.13 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.437 HG12 ' HE2' ' A' ' 87' ' ' LYS . 46.9 mt -87.69 97.57 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.1 pt -85.45 -10.58 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.737 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -165.66 117.12 0.73 Allowed Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.6 p -103.89 113.95 27.85 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 169.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 37.5 t -73.66 166.54 23.09 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.203 0.525 . . . . 0.0 110.926 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -74.35 147.72 41.94 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.318 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.552 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.94 118.19 17.63 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -95.88 163.5 13.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.773 0.829 . . . . 0.0 110.666 -176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.2 57.21 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.534 0.734 . . . . 0.0 111.253 -177.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.0 p -128.25 175.87 8.12 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.639 -178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.99 -20.52 61.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.025 0.93 . . . . 0.0 110.917 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -74.93 -42.76 57.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.832 0.853 . . . . 0.0 110.473 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.9 p -69.26 -22.11 63.85 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.822 0.449 . . . . 0.0 111.055 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.561 ' HE ' ' HB3' ' A' ' 84' ' ' PHE . 13.8 ttt180 -62.4 -41.81 98.96 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.626 0.37 . . . . 0.0 110.526 170.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -64.78 -36.1 83.24 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.256 0.622 . . . . 0.0 111.033 -177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.0 m -64.13 -36.85 85.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.881 171.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.88 -31.23 67.3 Favored Glycine 0 C--N 1.353 1.488 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.507 176.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.68 -49.57 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.93 -34.96 77.04 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.429 -1.259 . . . . 0.0 111.379 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t -69.1 -53.12 21.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.202 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.18 -31.56 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.628 0.771 . . . . 0.0 111.229 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -69.92 -50.5 41.5 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.362 0.665 . . . . 0.0 110.972 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.38 -19.25 36.42 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.394 0.678 . . . . 0.0 112.811 -173.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.526 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 91.0 m-20 -100.82 -30.77 11.51 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.647 0.779 . . . . 0.0 110.443 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.88 -17.26 77.53 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 116.089 -0.505 . . . . 0.0 113.62 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -71.18 -14.95 62.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.421 0.689 . . . . 0.0 111.65 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 98.2 p -65.68 -43.27 89.78 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 123.233 0.613 . . . . 0.0 110.223 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 59.25 19.78 7.89 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.705 1.202 . . . . 0.0 111.017 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.1 m -90.17 105.31 17.72 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.208 1.003 . . . . 0.0 109.457 -174.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.99 144.35 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 O-C-N 123.636 0.585 . . . . 0.0 110.895 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.533 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 25.8 mtpp -117.72 100.59 7.7 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 173.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.01 97.78 1.2 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.614 0.721 . . . . 0.0 109.49 -178.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.89 8.39 44.5 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.939 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 49.9 p . . . . . 0 CA--C 1.547 0.837 0 C-N-CA 123.193 0.597 . . . . 0.0 109.505 -179.997 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.312 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 36.1 p90 -154.81 167.14 31.24 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.831 0.852 . . . . 0.0 109.228 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -110.11 133.88 52.75 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.336 0.654 . . . . 0.0 110.035 177.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -98.77 106.13 18.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 165.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.27 128.74 34.96 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -147.02 166.41 26.92 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.823 0.449 . . . . 0.0 109.802 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -109.33 141.33 41.82 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.567 0.747 . . . . 0.0 109.189 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -86.49 -168.58 2.29 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.826 0.851 . . . . 0.0 111.306 -176.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.2 m -60.23 -27.29 67.08 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.614 0.765 . . . . 0.0 112.375 -179.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HB3' ' HG2' ' A' ' 30' ' ' GLN . 19.4 t70 -102.23 14.55 31.64 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.844 0.857 . . . . 0.0 110.494 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 62.04 17.84 9.42 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.567 1.147 . . . . 0.0 112.088 -173.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 28' ' ' ASP . 33.5 mm-40 -71.54 141.69 50.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.474 0.71 . . . . 0.0 110.058 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -90.77 115.72 28.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.401 0.681 . . . . 0.0 109.879 -165.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HB2' HD22 ' A' ' 48' ' ' LEU . 8.3 tpp180 -140.37 120.46 13.74 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.654 1.182 . . . . 0.0 108.36 -172.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -109.33 138.26 45.96 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.428 0.291 . . . . 0.0 110.345 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.57 132.8 54.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 173.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 13.8 tp -88.39 119.33 28.71 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -105.64 140.15 39.15 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.376 1.071 . . . . 0.0 109.076 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.24 178.5 5.09 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.373 0.669 . . . . 0.0 110.824 173.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -67.51 -17.29 68.55 Favored Glycine 0 C--N 1.35 1.35 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 174.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -66.77 -23.52 66.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.781 0.833 . . . . 0.0 110.946 170.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.35 -7.39 68.92 Favored Glycine 0 C--N 1.349 1.27 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.443 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -90.35 138.75 31.28 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.102 0.961 . . . . 0.0 110.531 -174.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.1 m -69.48 123.93 22.56 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.539 0.736 . . . . 0.0 110.889 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.401 HD12 ' HG ' ' A' ' 35' ' ' LEU . 25.9 pt -111.86 -19.87 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.578 1.151 . . . . 0.0 111.007 -178.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -156.01 154.91 31.81 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -173.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 96.5 m -155.86 129.19 8.23 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 125.184 1.394 . . . . 0.0 107.793 -176.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 83.2 p -72.75 -170.89 0.76 Allowed 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.677 0.671 . . . . 0.0 111.718 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -91.88 178.51 5.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.734 0.413 . . . . 0.0 110.833 165.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.412 HD22 ' HB2' ' A' ' 32' ' ' ARG . 72.8 mt -77.08 113.69 15.07 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.012 174.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -89.72 141.24 28.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.949 170.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 46.3 p -83.2 -11.61 57.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.176 0.59 . . . . 0.0 110.866 176.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.8 m -135.1 135.74 41.43 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.214 1.006 . . . . 0.0 110.285 177.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -28.16 69.61 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.871 0.868 . . . . 0.0 111.401 175.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.6 p -70.2 -31.66 69.22 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.453 0.701 . . . . 0.0 111.092 175.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -70.87 -27.99 64.24 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.611 0.364 . . . . 0.0 110.54 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.15 67.39 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.54 0.736 . . . . 0.0 111.355 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.413 ' HA ' HG22 ' A' ' 59' ' ' ILE . 0.3 OUTLIER -74.23 -29.37 61.68 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 176.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.15 -37.27 86.85 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 166.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.41 -48.91 78.74 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.009 0.818 . . . . 0.0 113.438 -178.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.413 HG22 ' HA ' ' A' ' 56' ' ' GLU . 10.5 tt -66.68 -33.59 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 120.878 0.371 . . . . 0.0 110.751 177.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.74 81.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.12 0.568 . . . . 0.0 110.703 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.1 m -75.55 -42.04 53.38 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.438 0.695 . . . . 0.0 111.878 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.9 m -66.06 -32.1 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.507 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 51.5 ttp180 -65.43 -47.06 77.51 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.417 1.087 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.3 t -64.1 -26.4 68.53 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.141 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.482 HD21 HD11 ' A' ' 94' ' ' ILE . 87.5 m-20 -105.88 10.85 32.35 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.921 0.888 . . . . 0.0 112.511 -174.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.4 m -65.22 -46.87 72.26 Favored Pre-proline 0 CA--C 1.564 1.492 0 CA-C-O 118.525 -0.75 . . . . 0.0 112.054 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.79 -14.13 14.1 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.719 1.613 . . . . 0.0 112.763 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -80.12 94.62 6.02 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.276 0.63 . . . . 0.0 109.454 -177.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.04 -35.6 75.46 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.702 0.801 . . . . 0.0 111.881 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -61.5 -27.34 68.52 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.776 0.83 . . . . 0.0 111.71 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -87.57 -29.76 21.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -171.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.566 ' HB3' ' HG ' ' A' ' 86' ' ' LEU . 14.2 p90 -115.42 125.63 53.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 119.448 1.022 . . . . 0.0 109.161 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -137.91 137.76 38.35 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.515 0.726 . . . . 0.0 110.398 -173.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.461 ' HA ' ' HD1' ' A' ' 84' ' ' PHE . 2.3 ptmm? -76.62 105.12 7.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.251 171.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -91.35 164.68 13.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.707 1.203 . . . . 0.0 110.737 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -127.52 123.76 36.64 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.771 0.828 . . . . 0.0 108.885 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.12 165.54 20.11 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.435 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -60.48 -26.1 66.54 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.98 0.912 . . . . 0.0 111.46 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -84.37 -4.18 58.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.826 0.85 . . . . 0.0 111.636 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.02 62.12 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 122.91 0.291 . . . . 0.0 113.075 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 32.9 mmtp -71.98 129.94 39.76 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.269 0.627 . . . . 0.0 111.446 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -77.49 144.11 37.98 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.366 177.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -151.69 169.24 22.66 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.461 ' HD1' ' HA ' ' A' ' 74' ' ' LYS . 20.4 m-85 -105.25 160.13 15.33 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 122.12 -0.363 . . . . 0.0 110.079 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -140.23 103.78 4.67 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 168.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.566 ' HG ' ' HB3' ' A' ' 72' ' ' TYR . 1.4 tt -86.65 109.24 19.05 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -87.68 154.58 20.47 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.404 1.482 . . . . 0.0 110.655 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.46 166.3 10.65 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.55 1.14 . . . . 0.0 110.008 174.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -21.49 66.56 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.524 0.73 . . . . 0.0 111.661 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -86.09 10.69 13.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.123 0.969 . . . . 0.0 111.404 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.0 m80 62.85 25.29 15.01 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 177.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -115.08 156.77 24.58 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.212 1.005 . . . . 0.0 109.631 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.9 mt -87.72 121.28 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 122.818 0.447 . . . . 0.0 110.108 -176.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.482 HD11 HD21 ' A' ' 65' ' ' ASN . 17.6 pt -106.15 -4.95 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.071 0.948 . . . . 0.0 110.51 174.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -154.07 139.34 6.74 Favored Glycine 0 C--N 1.345 1.071 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 84' ' ' PHE . 77.8 p -159.47 169.72 23.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.221 1.408 . . . . 0.0 108.67 -177.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.4 t -132.87 165.39 24.74 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.553 -0.717 . . . . 0.0 110.537 174.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -72.5 -72.97 0.21 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.94 0.896 . . . . 0.0 109.454 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.55 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 22.5 ptp -175.87 139.87 0.41 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.301 1.04 . . . . 0.0 109.993 175.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -104.71 104.16 13.91 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.46 1.104 . . . . 0.0 108.863 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.58 -39.46 84.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.537 0.735 . . . . 0.0 110.893 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.7 p -90.01 133.6 34.72 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.857 173.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.1 -31.76 69.48 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.55 1.14 . . . . 0.0 112.673 -172.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.25 -28.58 68.83 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.458 0.703 . . . . 0.0 111.764 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 41.7 m -64.25 -22.44 66.95 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.882 0.873 . . . . 0.0 112.473 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.406 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.3 ptt180 -69.01 -39.56 79.22 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.37 -50.74 13.43 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.563 0.745 . . . . 0.0 110.103 -176.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.3 m -59.47 -38.35 80.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.994 0.918 . . . . 0.0 110.959 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.82 -35.66 92.18 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.252 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.424 HG22 ' HE2' ' A' ' 72' ' ' TYR . 26.4 mm -58.46 -48.3 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 CA-C-N 117.456 0.628 . . . . 0.0 110.852 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.64 -38.51 90.54 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.135 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -70.84 -42.96 69.47 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.01 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 70.5 t -65.78 -39.01 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.843 0.857 . . . . 0.0 110.391 179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -64.14 -39.46 94.06 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.674 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.23 -36.68 39.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.658 0.783 . . . . 0.0 112.59 -176.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.97 -8.84 17.38 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.074 0.55 . . . . 0.0 111.83 -169.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.04 -34.37 86.57 Favored Glycine 0 C--N 1.346 1.094 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.507 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 15.3 t -75.89 -5.75 47.56 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 124.01 0.924 . . . . 0.0 111.91 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.2 t -65.5 141.66 58.4 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.831 0.453 . . . . 0.0 109.808 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -121.44 8.2 10.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.342 1.057 . . . . 0.0 110.948 -172.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.2 t -97.04 115.84 28.18 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.39 131.33 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.825 0.85 . . . . 0.0 110.199 -178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -92.32 110.28 21.67 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.631 0.772 . . . . 0.0 109.17 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -83.44 102.86 12.35 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.986 0.898 . . . . 0.0 110.159 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -91.77 -3.38 56.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.512 1.125 . . . . 0.0 110.21 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 27.0 p . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 124.034 0.933 . . . . 0.0 110.882 178.569 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 113.239 0.056 . . . . 0.0 113.239 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -153.05 150.61 29.34 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 123.873 0.869 . . . . 0.0 110.136 -178.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -87.05 143.46 27.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.213 177.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -129.71 111.72 12.93 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.0 tp -79.68 98.37 6.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.2 m -105.92 136.22 45.95 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.241 -170.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HB3' HG23 ' A' ' 126' ' ' THR . 19.4 ptmt -94.75 133.34 38.55 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 170.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 45.9 m -79.29 179.52 7.36 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.648 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.0 t -58.2 -37.98 75.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.046 0.538 . . . . 0.0 111.458 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -92.55 22.52 4.6 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 123.811 0.845 . . . . 0.0 110.77 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 64.31 19.59 11.85 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.513 1.125 . . . . 0.0 112.817 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -77.59 120.75 22.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.16 0.584 . . . . 0.0 109.692 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.401 ' O ' ' HB2' ' A' ' 49' ' ' TYR . 50.1 m-85 -89.52 124.2 34.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.645 0.778 . . . . 0.0 109.594 -170.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HB2' ' HB2' ' A' ' 46' ' ' SER . 35.9 ptt180 -157.29 158.09 35.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.353 0.661 . . . . 0.0 109.877 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.471 ' HE2' HG23 ' A' ' 122' ' ' VAL . 16.7 m-85 -91.31 141.23 29.0 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.93 0.492 . . . . 0.0 109.805 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.8 m -120.67 131.26 73.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 167.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -97.34 111.8 23.89 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -90.41 138.29 31.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.5 176.0 5.07 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.481 0.712 . . . . 0.0 110.135 169.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -60.19 -24.36 60.94 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 114.088 0.395 . . . . 0.0 114.088 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -81.26 0.4 36.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.291 1.037 . . . . 0.0 112.173 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.3 -0.71 89.55 Favored Glycine 0 C--N 1.353 1.512 0 C-N-CA 122.803 0.24 . . . . 0.0 113.599 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -88.21 130.56 35.04 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.455 0.702 . . . . 0.0 110.336 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.8 m -71.95 121.9 19.89 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.294 0.638 . . . . 0.0 110.287 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 pt -102.58 -32.08 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.452 1.101 . . . . 0.0 110.815 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 34.6 tp -132.18 149.45 52.39 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.993 0.917 . . . . 0.0 109.662 -172.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 91.6 m -152.99 125.77 8.35 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.411 1.084 . . . . 0.0 109.462 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.589 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 5.6 m -66.97 170.79 6.2 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.011 0.924 . . . . 0.0 110.583 175.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.1 168.11 20.62 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -71.3 112.48 7.47 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 84.9 m-85 -104.95 137.16 43.14 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 m -73.99 -28.74 61.61 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.161 0.505 . . . . 0.0 110.092 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.48 ' HB3' HG23 ' A' ' 53' ' ' THR . 17.6 m -105.32 132.59 51.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.624 0.77 . . . . 0.0 110.151 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -26.84 62.12 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.231 0.613 . . . . 0.0 111.316 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 9.5 t -62.09 -36.41 81.62 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.751 0.657 . . . . 0.0 110.89 174.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 m -65.83 -39.06 90.46 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 110.819 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.26 86.39 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.601 0.76 . . . . 0.0 110.455 174.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.64 -34.2 77.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.742 0.817 . . . . 0.0 110.839 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 53' ' ' THR . 64.1 mmtt -76.53 -30.33 57.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.28 -41.61 98.42 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 114.062 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -65.66 -42.32 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 117.112 0.456 . . . . 0.0 111.035 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.11 -36.28 83.79 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.967 0.507 . . . . 0.0 110.74 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.3 m -71.66 -46.03 60.16 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.695 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 33.6 m -67.15 -28.97 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 118.204 0.456 . . . . 0.0 110.8 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -69.21 -38.47 78.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.342 0.657 . . . . 0.0 110.491 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.5 t -76.31 -36.83 58.12 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.855 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -93.0 8.44 39.89 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.18 0.992 . . . . 0.0 111.465 -176.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.489 ' OG ' ' HA ' ' A' ' 114' ' ' LYS . 16.9 t -62.33 -44.94 89.73 Favored Pre-proline 0 CA--C 1.571 1.762 0 C-N-CA 124.709 1.203 . . . . 0.0 112.222 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.81 -6.73 6.62 Favored 'Trans proline' 0 C--N 1.393 2.904 0 C-N-CA 121.845 1.696 . . . . 0.0 113.479 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -83.89 85.75 7.27 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.99 0.516 . . . . 0.0 110.112 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.33 -23.3 67.35 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.864 0.866 . . . . 0.0 112.593 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -66.79 -34.9 78.84 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.649 0.78 . . . . 0.0 111.189 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -76.36 -20.9 56.75 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.11 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -73.21 116.21 13.48 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -96.24 98.38 10.26 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 147.43 38.82 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.946 0.403 . . . . 0.0 110.139 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -144.62 167.96 21.29 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.916 1.287 . . . . 0.0 109.129 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.4 m -126.73 114.73 18.37 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.278 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.11 154.7 5.33 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.855 1.262 . . . . 0.0 111.221 172.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 p -68.92 -12.94 62.11 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.631 0.772 . . . . 0.0 112.266 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -79.74 1.83 25.14 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.55 0.74 . . . . 0.0 111.948 170.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.48 10.59 84.3 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.172 0.295 . . . . 0.0 112.874 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -88.35 141.33 28.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.609 0.764 . . . . 0.0 110.154 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -101.77 128.56 48.05 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.964 0.506 . . . . 0.0 110.119 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.612 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 30.0 p90 -142.75 175.52 9.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -133.96 158.79 42.59 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 122.966 0.506 . . . . 0.0 110.153 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -127.05 100.72 6.24 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.52 HD21 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.27 111.54 18.44 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 173.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.41 ' HE2' HG12 ' A' ' 93' ' ' ILE . 16.2 ptpt -127.93 155.37 44.32 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.558 0.343 . . . . 0.0 110.177 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.47 178.79 6.45 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.464 0.705 . . . . 0.0 110.692 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.28 -10.81 57.33 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.499 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.493 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 2.0 m-20 -80.86 5.4 16.17 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.295 1.038 . . . . 0.0 111.621 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 67.8 11.27 8.29 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.805 1.242 . . . . 0.0 111.976 -178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.493 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 4.0 pt20 -106.87 135.11 48.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.781 0.433 . . . . 0.0 110.955 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.41 HG12 ' HE2' ' A' ' 87' ' ' LYS . 55.9 mt -70.85 99.47 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 123.922 0.889 . . . . 0.0 110.131 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.52 HD11 HD21 ' A' ' 86' ' ' LEU . 18.3 pt -79.05 -12.91 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.313 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.44 146.54 9.58 Favored Glycine 0 C--O 1.215 -1.035 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.1 p -166.7 167.16 15.45 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 117.743 0.771 . . . . 0.0 109.772 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.2 t -113.75 165.25 12.74 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -76.78 -54.57 6.45 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.612 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 26.7 ptt? 174.33 131.52 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.75 1.62 . . . . 0.0 108.402 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.51 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 97.3 m-85 -98.28 156.87 16.51 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.072 0.549 . . . . 0.0 109.941 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.65 64.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.822 0.849 . . . . 0.0 111.213 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.5 p -130.39 177.1 7.59 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.54 0.736 . . . . 0.0 110.623 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.37 -28.56 65.21 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.845 172.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -61.82 -40.58 95.79 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.292 0.637 . . . . 0.0 110.572 172.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.51 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 14.6 m -68.55 -35.64 77.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.786 178.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -68.34 -46.14 70.99 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.969 0.508 . . . . 0.0 111.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.09 -28.59 65.53 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.779 0.432 . . . . 0.0 111.357 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 m -64.41 -40.58 96.06 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 168.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.68 99.63 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.785 175.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.9 mm -60.4 -48.88 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.714 0.805 . . . . 0.0 110.258 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.29 83.2 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.298 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.97 -37.55 61.9 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.695 -178.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.57 -30.69 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 123.288 0.635 . . . . 0.0 110.13 176.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.489 ' HA ' ' OG ' ' A' ' 66' ' ' SER . 37.9 ttpt -70.23 -45.1 67.2 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 120.929 0.395 . . . . 0.0 110.81 172.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.69 -28.74 66.1 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.847 0.859 . . . . 0.0 111.924 -177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.78 -10.23 14.79 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.654 0.781 . . . . 0.0 111.415 -174.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.1 -23.79 75.22 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 112.024 -0.431 . . . . 0.0 112.024 175.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 25.4 p -78.45 -0.52 29.64 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.285 1.034 . . . . 0.0 112.406 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.6 t -70.85 135.69 48.23 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.482 0.713 . . . . 0.0 110.847 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -90.7 -16.48 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 110.335 175.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.5 m -73.98 93.16 2.19 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.752 0.821 . . . . 0.0 110.892 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . 0.471 HG23 ' HE2' ' A' ' 33' ' ' PHE . 2.0 p -96.63 132.99 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.548 ' HZ2' ' HB3' ' A' ' 123' ' ' LYS . 8.3 mtpm? -126.23 106.6 9.65 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.899 0.88 . . . . 0.0 109.211 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.68 101.85 3.77 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.119 0.568 . . . . 0.0 110.86 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -76.26 -26.25 55.77 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 123.827 0.851 . . . . 0.0 109.977 169.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.52 HG23 ' HB3' ' A' ' 25' ' ' LYS . 31.3 p . . . . . 0 CA--C 1.544 0.729 0 C-N-CA 124.323 1.049 . . . . 0.0 110.95 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.424 0 CA-C-O 120.749 0.083 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 29.5 p90 -141.08 148.75 40.65 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 123.319 0.647 . . . . 0.0 110.368 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.431 ' HB3' ' HD1' ' A' ' 33' ' ' PHE . 85.6 m-85 -98.41 120.29 38.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.943 175.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.44 ' HG2' ' HD3' ' A' ' 123' ' ' LYS . 44.5 mt-10 -92.62 114.09 26.55 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 173.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 31' ' ' PHE . 52.4 tp -80.61 96.63 6.91 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 172.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.7 p -105.04 148.54 26.66 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.134 1.373 . . . . 0.0 109.826 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -102.1 160.25 14.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.51 0.724 . . . . 0.0 111.13 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 96.5 p -89.94 -175.46 4.6 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 166.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.3 p -64.03 -20.21 65.75 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.082 0.553 . . . . 0.0 111.338 172.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -103.01 17.67 23.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.279 1.032 . . . . 0.0 111.339 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 64.74 16.48 10.43 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.841 1.257 . . . . 0.0 112.683 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -72.96 138.51 46.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.074 0.549 . . . . 0.0 110.066 -179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.518 ' HB3' HD12 ' A' ' 23' ' ' LEU . 77.7 m-85 -89.43 133.95 34.31 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.129 0.972 . . . . 0.0 110.159 -166.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.505 ' HB2' HD13 ' A' ' 48' ' ' LEU . 24.4 ttp180 -148.75 120.72 8.21 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -172.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.431 ' HD1' ' HB3' ' A' ' 21' ' ' PHE . 23.5 m-85 -90.2 124.1 34.57 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.424 HG11 HG23 ' A' ' 45' ' ' THR . 35.4 m -111.18 131.71 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 21.7 tp -100.3 116.43 32.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 95.7 mttt -101.58 128.07 48.0 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 170.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.14 166.75 7.35 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.948 0.78 . . . . 0.0 111.349 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.57 -2.5 35.83 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-N 115.818 -0.628 . . . . 0.0 114.571 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -86.7 -14.0 43.78 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.505 0.722 . . . . 0.0 110.64 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.34 -5.64 41.55 Favored Glycine 0 C--N 1.351 1.405 0 C-N-CA 123.592 0.615 . . . . 0.0 113.758 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -97.46 139.86 32.76 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.295 0.638 . . . . 0.0 110.713 -176.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 20.5 m -67.41 143.81 56.1 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.044 0.938 . . . . 0.0 109.822 174.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -132.43 -20.5 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.961 0.905 . . . . 0.0 111.362 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -152.5 149.39 28.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.426 0.69 . . . . 0.0 109.498 -170.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.424 HG23 HG11 ' A' ' 34' ' ' VAL . 72.1 m -148.79 117.93 6.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.197 0.999 . . . . 0.0 109.273 177.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.8 t -79.33 172.49 13.72 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.391 0.676 . . . . 0.0 111.062 177.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.42 173.64 9.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.147 0.579 . . . . 0.0 111.649 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.4 mm? -82.83 111.36 18.66 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.476 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.6 m-85 -88.72 131.13 35.16 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.822 1.249 . . . . 0.0 109.164 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -66.49 -30.24 70.53 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.727 0.811 . . . . 0.0 111.414 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.6 m -125.52 143.97 50.76 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.709 0.804 . . . . 0.0 110.446 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.95 68.64 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.818 0.847 . . . . 0.0 111.017 175.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.5 p -62.05 -43.08 99.61 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.38 1.072 . . . . 0.0 110.793 176.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.476 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 8.3 m -65.52 -37.86 87.99 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.153 0.981 . . . . 0.0 110.073 178.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.9 -38.53 88.96 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.943 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.7 -39.66 94.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.08 0.552 . . . . 0.0 110.564 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.93 -37.52 86.26 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.575 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.4 76.36 Favored Glycine 0 C--N 1.35 1.334 0 O-C-N 123.878 0.736 . . . . 0.0 112.868 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.443 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.0 tt -72.04 -31.71 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 122.849 0.459 . . . . 0.0 111.118 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.42 87.24 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.99 0.516 . . . . 0.0 110.356 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.4 m -70.4 -52.14 24.51 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.955 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 59' ' ' ILE . 21.3 m -58.26 -33.05 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 122.585 0.354 . . . . 0.0 111.85 -173.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -66.99 -43.18 83.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.868 0.867 . . . . 0.0 110.799 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.6 t -69.59 -36.06 75.9 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.285 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.412 ' HB3' HD22 ' A' ' 86' ' ' LEU . 13.4 m120 -88.26 -0.42 57.1 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.027 0.931 . . . . 0.0 111.979 -174.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.626 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.5 m -55.03 -52.13 73.7 Favored Pre-proline 0 CA--C 1.565 1.534 0 C-N-CA 123.773 0.829 . . . . 0.0 112.425 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -81.26 -12.53 11.58 Favored 'Trans proline' 0 C--N 1.392 2.818 0 C-N-CA 121.914 1.743 . . . . 0.0 113.034 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -85.62 86.64 7.36 Favored 'General case' 0 C--N 1.351 0.646 0 C-N-CA 123.468 0.707 . . . . 0.0 109.979 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -62.54 -21.77 65.8 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.622 0.769 . . . . 0.0 111.459 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HG3' ' HE ' ' A' ' 71' ' ' ARG . 11.7 tp10 -52.8 -36.28 58.11 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.319 1.448 . . . . 0.0 111.634 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' HE ' ' HG3' ' A' ' 70' ' ' GLU . 5.1 mmp_? -90.27 0.77 57.07 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.58 0.752 . . . . 0.0 112.884 -174.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -99.48 134.13 42.8 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.911 0.484 . . . . 0.0 110.204 175.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 16.7 mm-40 -100.09 92.93 5.47 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.212 1.005 . . . . 0.0 108.363 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -89.1 101.36 14.02 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.745 0.783 . . . . 0.0 108.961 -176.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -136.16 173.22 11.95 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.698 0.799 . . . . 0.0 110.543 -170.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -120.98 128.01 52.32 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.744 0.817 . . . . 0.0 109.924 -176.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.0 160.43 32.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.726 0.811 . . . . 0.0 109.882 169.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.0 m -65.38 -10.96 37.7 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.196 0.598 . . . . 0.0 112.264 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -76.27 -5.18 45.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.038 0.935 . . . . 0.0 111.385 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.42 9.24 85.16 Favored Glycine 0 C--N 1.351 1.4 0 C-N-CA 123.306 0.479 . . . . 0.0 112.197 -174.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -97.22 132.81 42.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.242 0.617 . . . . 0.0 111.115 -173.313 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.639 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 62.4 m-85 -94.59 133.89 37.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.322 1.049 . . . . 0.0 110.597 -173.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -145.31 174.8 10.79 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.86 0.864 . . . . 0.0 109.245 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.471 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 24.9 p90 -138.69 134.26 33.39 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.277 0.631 . . . . 0.0 110.198 174.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.524 ' HB3' HD11 ' A' ' 93' ' ' ILE . 95.3 m-20 -110.04 120.6 42.96 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.574 0.75 . . . . 0.0 109.402 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.495 HD21 HD12 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.2 129.3 34.8 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -105.5 137.06 43.95 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.45 1.1 . . . . 0.0 110.448 -168.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.23 169.69 8.3 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.509 0.723 . . . . 0.0 110.082 173.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.59 -21.4 66.33 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.797 0.839 . . . . 0.0 111.904 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 11.5 m120 -85.79 4.67 35.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.811 0.844 . . . . 0.0 111.784 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.5 m170 70.73 -1.16 2.7 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.276 1.43 . . . . 0.0 112.82 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.41 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 30.0 pt20 -75.99 149.33 37.61 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 123.168 0.587 . . . . 0.0 110.467 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.524 HD11 ' HB3' ' A' ' 85' ' ' ASN . 41.4 mm -87.37 99.59 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.495 HD12 HD21 ' A' ' 86' ' ' LEU . 12.5 pt -79.14 -4.79 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.83 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.16 94.16 0.1 OUTLIER Glycine 0 C--N 1.342 0.871 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.6 p -88.52 125.87 34.98 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.3 t -79.27 169.99 17.29 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 121.675 0.75 . . . . 0.0 110.948 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -74.41 150.91 39.78 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.119 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 16.5 ptm -76.55 116.5 17.29 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.433 ' HB3' ' OG ' ' A' ' 105' ' ' SER . 62.9 m-85 -102.91 153.16 20.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.856 0.862 . . . . 0.0 111.291 -173.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.85 -52.39 11.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.036 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.2 p -104.18 163.87 12.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.093 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.01 -27.51 61.82 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.05 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.5 -42.13 95.7 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.445 0.698 . . . . 0.0 111.278 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 100' ' ' TYR . 34.5 p -73.29 -30.79 63.64 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.198 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.639 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 27.0 ptt180 -76.87 -36.3 56.86 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.07 0.395 . . . . 0.0 111.446 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.24 -29.87 60.35 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.884 0.373 . . . . 0.0 110.76 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.9 m -69.35 -33.88 73.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.53 167.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.22 -37.38 94.46 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.535 173.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.9 mm -59.82 -48.34 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 174.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.47 -36.23 79.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.361 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -71.25 -52.13 20.68 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.154 0.582 . . . . 0.0 110.831 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.72 -31.05 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.542 0.737 . . . . 0.0 110.928 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 27.6 ttpp -70.04 -39.47 75.73 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.627 0.771 . . . . 0.0 111.527 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.91 -47.7 43.53 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.495 0.718 . . . . 0.0 111.56 -178.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.06 -20.16 19.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -169.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -69.76 -27.01 73.76 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 123.322 0.389 . . . . 0.0 113.164 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.607 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 72.5 p -67.66 -30.35 69.87 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.646 0.778 . . . . 0.0 111.436 176.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.3 m -83.58 88.05 7.03 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.749 0.82 . . . . 0.0 109.89 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.87 62.53 5.71 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.54 0.686 . . . . 0.0 110.789 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.8 t -101.81 110.72 22.76 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 173.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.9 t -96.42 114.5 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.689 0.796 . . . . 0.0 110.846 -171.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.44 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 84.8 tttt -83.57 115.54 22.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.06 0.944 . . . . 0.0 108.483 166.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -73.86 131.69 41.75 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 0.0 110.287 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -138.91 -8.1 1.39 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.069 0.948 . . . . 0.0 110.395 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.1 p . . . . . 0 CA--C 1.549 0.907 0 CA-C-O 121.084 0.468 . . . . 0.0 110.211 174.794 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.41 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.527 0.783 0 N-CA-C 113.657 0.223 . . . . 0.0 113.657 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.4 p90 -162.75 165.87 24.98 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.753 0.821 . . . . 0.0 110.683 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 69.1 m-85 -105.44 157.58 17.25 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.534 1.134 . . . . 0.0 108.731 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.483 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 74.8 mt-10 -137.18 110.09 7.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 169.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.7 tp -92.82 106.14 18.15 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 m -129.35 152.0 49.38 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.54 ' HE3' ' HB ' ' A' ' 126' ' ' THR . 19.1 ptpt -106.51 148.59 28.03 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.038 0.446 . . . . 0.0 110.4 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -72.4 -178.03 2.4 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.345 1.058 . . . . 0.0 111.264 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.0 t -66.74 -29.74 69.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 122.875 0.47 . . . . 0.0 111.247 -178.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -86.52 15.15 5.78 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.026 0.53 . . . . 0.0 111.585 174.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 17.3 m120 68.68 14.03 8.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.912 1.285 . . . . 0.0 112.748 171.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.48 134.23 35.5 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.605 0.762 . . . . 0.0 109.272 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -86.97 140.52 29.5 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.544 0.738 . . . . 0.0 110.134 -169.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -152.72 115.7 4.6 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -93.35 138.2 31.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.528 HG11 HG22 ' A' ' 45' ' ' THR . 30.4 m -110.8 153.77 12.52 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 172.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.419 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -117.35 123.16 45.81 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.443 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -119.76 146.24 45.83 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 110.359 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.486 ' HA ' HD22 ' A' ' 116' ' ' ASN . . . -75.4 -178.71 4.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.77 0.828 . . . . 0.0 110.552 172.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -66.14 -17.98 66.47 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.562 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -88.33 -2.37 58.56 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.906 0.882 . . . . 0.0 112.192 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.37 2.82 88.98 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 113.989 0.355 . . . . 0.0 113.989 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -81.68 126.76 32.17 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.029 0.531 . . . . 0.0 110.095 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.1 m -70.09 120.63 16.08 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 pt -100.25 -26.49 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.965 1.306 . . . . 0.0 111.016 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.8 tp -151.54 120.93 6.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.368 0.667 . . . . 0.0 109.395 -174.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.528 HG22 HG11 ' A' ' 34' ' ' VAL . 59.4 m -119.63 122.07 40.71 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.417 0.687 . . . . 0.0 109.543 176.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.5 t -73.93 -176.28 2.43 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 122.764 0.426 . . . . 0.0 110.569 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -91.94 178.19 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.72 0.408 . . . . 0.0 110.469 172.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.6 mp -84.47 112.42 20.36 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -178.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -90.33 115.85 27.84 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.145 0.978 . . . . 0.0 108.569 170.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.4 p -69.97 -7.73 43.14 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.01 0.524 . . . . 0.0 111.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.9 m -119.33 135.31 54.78 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.546 1.138 . . . . 0.0 109.738 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -29.36 69.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.929 0.492 . . . . 0.0 110.655 174.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -63.98 -43.78 94.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.125 0.97 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.7 p -74.41 -28.27 61.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.176 0.59 . . . . 0.0 111.362 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.58 -36.01 82.5 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.95 0.5 . . . . 0.0 110.616 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -73.17 -37.19 66.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.578 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -61.07 -39.98 91.94 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.499 172.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.01 85.24 Favored Glycine 0 C--N 1.348 1.244 0 O-C-N 123.867 0.73 . . . . 0.0 113.226 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.2 tt -71.39 -32.0 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 CA-C-O 120.925 0.393 . . . . 0.0 111.0 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 -30.96 70.26 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.799 0.44 . . . . 0.0 110.557 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 m -74.06 -43.32 58.22 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.087 178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.27 -27.95 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 CA-C-N 118.276 0.489 . . . . 0.0 110.521 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.29 -44.32 79.53 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.648 0.779 . . . . 0.0 109.498 176.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -78.08 -26.64 48.26 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.0 0.52 . . . . 0.0 111.497 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -103.26 13.68 33.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.88 0.872 . . . . 0.0 111.381 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.422 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 57.4 p -66.92 -45.89 54.03 Favored Pre-proline 0 CA--C 1.565 1.537 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.828 173.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.29 -7.07 15.97 Favored 'Trans proline' 0 C--N 1.397 3.097 0 CA-C-N 121.873 1.705 . . . . 0.0 112.433 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -83.1 77.16 9.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.537 0.735 . . . . 0.0 110.373 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -60.6 -35.82 77.06 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.703 1.201 . . . . 0.0 112.362 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -74.87 -23.9 58.47 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.272 0.629 . . . . 0.0 110.969 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -77.19 -21.37 54.04 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 123.341 0.657 . . . . 0.0 110.649 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -73.87 104.61 4.81 Favored 'General case' 0 C--N 1.356 0.886 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 167.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -96.86 113.23 24.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.282 0.633 . . . . 0.0 109.292 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 147.05 34.03 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 173.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -147.58 135.59 21.28 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.278 1.031 . . . . 0.0 108.954 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.7 m -98.32 125.19 43.34 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.07 164.85 26.1 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.025 0.93 . . . . 0.0 110.893 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -69.17 -26.37 64.82 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.435 0.694 . . . . 0.0 110.341 178.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -76.35 -4.64 43.33 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.43 1.092 . . . . 0.0 111.244 174.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.44 10.07 74.53 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.868 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -81.44 122.46 27.54 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 122.993 0.517 . . . . 0.0 110.306 -177.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -88.36 126.79 35.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -147.57 175.34 10.93 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -127.0 161.59 28.01 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.381 0.672 . . . . 0.0 110.503 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -140.42 124.19 17.24 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.439 1.096 . . . . 0.0 108.404 176.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.0 tp -84.57 106.59 16.25 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 172.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.412 ' HE3' ' HA ' ' A' ' 91' ' ' HIS . 2.8 tmtm? -86.38 150.13 24.53 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.9 34.38 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.244 0.617 . . . . 0.0 110.365 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.53 -14.48 51.56 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.463 0.705 . . . . 0.0 111.931 177.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -85.94 14.82 5.57 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 0.0 111.475 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . 0.412 ' HA ' ' HE3' ' A' ' 87' ' ' LYS . 71.8 m80 67.07 19.13 10.53 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.905 1.282 . . . . 0.0 112.164 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -109.76 147.45 33.2 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.682 0.793 . . . . 0.0 109.914 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.9 mm -90.12 105.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 170.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.7 pt -87.55 -7.87 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.16 145.71 9.08 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 123.407 0.442 . . . . 0.0 112.605 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -154.45 122.38 5.92 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.205 1.402 . . . . 0.0 108.917 174.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.8 p -67.89 153.74 43.07 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 172.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -60.59 -78.59 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.815 0.697 . . . . 0.0 111.169 -174.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.401 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 24.9 ptt? -173.28 121.97 0.37 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.389 1.076 . . . . 0.0 108.966 176.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -103.27 148.94 25.21 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.71 -37.53 35.47 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.636 174.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.6 p -114.45 147.76 38.81 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.357 0.663 . . . . 0.0 111.76 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.63 -22.45 64.41 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.535 176.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -58.82 -45.11 90.73 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.69 0.796 . . . . 0.0 111.164 173.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m -73.0 -23.99 60.7 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.363 0.665 . . . . 0.0 111.29 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.429 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.9 mtp180 -62.69 -51.11 68.48 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.663 0.385 . . . . 0.0 110.28 168.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -66.54 -34.61 78.29 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.943 0.897 . . . . 0.0 111.061 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.7 m -70.32 -34.68 72.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.929 0.492 . . . . 0.0 109.936 174.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.458 ' O ' HG21 ' A' ' 113' ' ' VAL . . . -61.14 -50.68 64.59 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.448 173.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 106' ' ' ARG . 40.7 mm -56.4 -45.28 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.244 1.018 . . . . 0.0 110.065 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.84 89.5 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.821 0.848 . . . . 0.0 110.849 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.5 t -73.16 -34.94 66.33 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.763 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.458 HG21 ' O ' ' A' ' 109' ' ' GLY . 75.4 t -69.31 -37.28 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.139 0.576 . . . . 0.0 110.943 -178.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HB2' ' HZ3' ' A' ' 114' ' ' LYS . 10.4 mtmp? -69.93 -37.81 76.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.726 0.41 . . . . 0.0 110.616 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.62 76.19 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.71 177.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.486 HD22 ' HA ' ' A' ' 37' ' ' ALA . 2.4 m-20 -85.25 -11.42 54.88 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.145 0.978 . . . . 0.0 111.588 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.07 -36.23 60.67 Favored Glycine 0 C--N 1.344 0.997 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.8 t -82.58 -2.29 53.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.321 0.648 . . . . 0.0 111.308 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.4 t -73.61 160.39 31.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.345 0.658 . . . . 0.0 110.318 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.91 2.8 3.15 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.224 0.61 . . . . 0.0 111.517 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.2 t -79.82 101.25 8.4 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.212 0.605 . . . . 0.0 110.019 178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 m -110.07 141.72 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.03 0.532 . . . . 0.0 109.795 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.483 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 96.6 mttt -106.66 101.48 10.93 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.63 107.07 13.13 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -113.88 15.31 18.6 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.153 0.981 . . . . 0.0 110.922 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.54 ' HB ' ' HE3' ' A' ' 25' ' ' LYS . 46.4 p . . . . . 0 CA--C 1.545 0.786 0 C-N-CA 123.095 0.558 . . . . 0.0 111.56 -176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.453 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.407 ' HA ' HG22 ' A' ' 121' ' ' THR . 43.5 p90 -157.58 155.3 29.93 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.881 0.872 . . . . 0.0 110.051 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.424 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 73.3 m-85 -98.72 140.83 32.34 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.881 0.873 . . . . 0.0 108.772 174.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 37.3 mt-10 -126.35 111.09 14.1 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 170.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 21.3 tp -92.67 100.22 12.77 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.445 0.698 . . . . 0.0 109.216 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.4 t -116.34 152.61 33.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.87 0.868 . . . . 0.0 109.1 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -95.4 158.09 15.61 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 74.0 p -92.74 173.83 7.57 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.339 0.655 . . . . 0.0 110.381 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 t -69.07 -19.78 64.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.229 0.612 . . . . 0.0 109.87 170.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -87.86 9.31 22.37 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.75 0.82 . . . . 0.0 110.36 172.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 79.77 -22.07 0.3 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 125.254 1.422 . . . . 0.0 113.129 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -68.87 136.06 52.06 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.554 0.741 . . . . 0.0 111.222 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -92.38 131.07 37.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.932 0.893 . . . . 0.0 109.704 -170.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -147.17 121.63 9.7 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.598 0.759 . . . . 0.0 109.549 -173.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -93.07 141.97 27.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.522 HG11 HG23 ' A' ' 45' ' ' THR . 27.6 m -117.45 136.09 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.366 1.066 . . . . 0.0 109.677 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.424 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -91.83 115.61 28.2 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -109.72 123.92 50.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.155 0.982 . . . . 0.0 108.673 174.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.66 170.73 4.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.91 0.484 . . . . 0.0 110.959 172.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.4 -10.13 46.91 Favored Glycine 0 N--CA 1.477 1.415 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.23 -8.34 58.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.614 1.166 . . . . 0.0 110.876 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.06 10.88 84.36 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.883 -176.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -101.85 132.36 47.67 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.13 0.972 . . . . 0.0 109.813 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.0 m -70.17 118.32 12.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 pt -99.78 -16.43 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.167 0.987 . . . . 0.0 110.964 -178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.9 tp -154.65 139.1 16.8 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.522 HG23 HG11 ' A' ' 34' ' ' VAL . 40.4 m -135.29 123.44 22.94 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.8 t -79.98 177.68 8.76 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.46 0.704 . . . . 0.0 111.755 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -72.36 166.68 22.04 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.236 0.614 . . . . 0.0 111.812 172.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.01 113.21 18.0 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 171.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -93.66 138.73 31.58 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.423 0.689 . . . . 0.0 109.947 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t -74.69 -13.78 60.66 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.441 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.8 m -139.31 148.79 43.43 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.832 0.853 . . . . 0.0 110.143 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.8 tmmm? -64.63 -38.72 91.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.285 1.034 . . . . 0.0 108.678 176.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -62.85 -34.46 77.39 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.544 0.738 . . . . 0.0 111.741 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.0 m -64.83 -32.76 74.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.22 0.608 . . . . 0.0 111.158 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.12 -29.29 62.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.135 0.574 . . . . 0.0 111.314 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 -37.86 74.94 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.353 0.661 . . . . 0.0 110.077 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.603 ' HZ1' ' HB3' ' A' ' 57' ' ' LYS . 8.0 mtpm? -66.39 -35.01 79.24 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.956 171.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.97 91.66 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.586 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.513 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.7 tt -68.16 -36.45 75.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.034 0 CA-C-N 116.952 0.376 . . . . 0.0 110.368 177.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.11 -36.03 72.3 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.012 0.525 . . . . 0.0 110.736 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.0 m -73.64 -47.82 37.13 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.43 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.513 HG21 ' HA ' ' A' ' 59' ' ' ILE . 11.1 m -66.42 -28.71 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-N 117.708 0.231 . . . . 0.0 110.854 -178.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.603 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 78.7 ttt-85 -78.22 -39.07 41.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.351 1.06 . . . . 0.0 110.684 -176.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.1 t -70.21 -35.09 73.67 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.3 175.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -97.62 4.59 50.13 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.812 0.845 . . . . 0.0 111.272 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -66.25 -46.52 61.41 Favored Pre-proline 0 CA--C 1.562 1.407 0 C-N-CA 123.904 0.882 . . . . 0.0 111.668 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.63 -18.68 32.73 Favored 'Trans proline' 0 C--N 1.393 2.914 0 C-N-CA 121.761 1.64 . . . . 0.0 112.818 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -95.72 97.23 9.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.957 0.503 . . . . 0.0 110.762 -172.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -21.61 66.71 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.209 0.603 . . . . 0.0 111.721 175.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.38 -33.65 21.35 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.783 1.633 . . . . 0.0 111.775 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -96.03 16.63 17.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.931 0.892 . . . . 0.0 112.069 -172.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -111.01 131.75 54.79 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 6.4 mm-40 -96.21 97.89 9.88 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.979 0.912 . . . . 0.0 109.196 -176.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.405 ' O ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.78 105.41 2.75 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.901 0.751 . . . . 0.0 109.915 179.167 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -136.56 160.99 37.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.498 0.719 . . . . 0.0 110.324 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.0 m -127.57 116.48 20.41 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.725 176.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.52 153.23 13.28 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 110.858 170.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -61.65 -15.26 38.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.839 0.856 . . . . 0.0 112.452 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -86.61 11.72 12.19 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.879 0.871 . . . . 0.0 111.618 178.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.28 24.84 74.54 Favored Glycine 0 C--N 1.352 1.437 0 O-C-N 123.105 0.253 . . . . 0.0 112.738 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -109.4 123.12 48.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.351 0.66 . . . . 0.0 110.219 -175.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -79.68 135.38 36.53 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.495 0.718 . . . . 0.0 109.905 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -151.47 140.07 20.67 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 4.0 m-85 -109.52 133.22 53.35 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.441 HD21 HD13 ' A' ' 93' ' ' ILE . 9.6 m-20 -105.63 125.38 50.91 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.442 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.86 122.36 28.13 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -86.24 138.23 32.02 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.438 1.095 . . . . 0.0 109.644 -175.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.515 ' HB3' HG21 ' A' ' 94' ' ' ILE . . . -95.15 168.25 10.87 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.904 0.882 . . . . 0.0 110.37 175.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.15 -19.48 62.42 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.233 0.613 . . . . 0.0 111.051 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.445 ' HB3' ' HG2' ' A' ' 92' ' ' GLN . 62.1 t30 -82.72 0.85 41.56 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.891 0.877 . . . . 0.0 111.543 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 69.43 18.08 7.95 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.688 1.195 . . . . 0.0 111.62 -176.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.445 ' HG2' ' HB3' ' A' ' 90' ' ' ASN . 4.2 pt20 -100.87 -170.49 1.85 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.634 0.774 . . . . 0.0 109.236 173.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.441 HD13 HD21 ' A' ' 85' ' ' ASN . 59.3 mt -106.63 148.01 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 175.359 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.515 HG21 ' HB3' ' A' ' 88' ' ' ALA . 5.6 pt -126.83 -1.15 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.25 1.02 . . . . 0.0 111.058 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 176.78 104.2 0.18 Allowed Glycine 0 C--N 1.35 1.361 0 N-CA-C 114.118 0.407 . . . . 0.0 114.118 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 m -88.83 125.87 35.1 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 98.6 p -75.81 167.37 22.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 120.76 0.314 . . . . 0.0 111.088 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -60.94 157.31 15.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.699 0.8 . . . . 0.0 110.613 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -78.7 119.43 21.92 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 121.17 0.509 . . . . 0.0 109.892 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -98.47 120.11 38.32 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.97 0.908 . . . . 0.0 109.543 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.09 -35.29 71.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.992 0.517 . . . . 0.0 110.774 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 m -100.25 154.47 18.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.286 0.634 . . . . 0.0 110.413 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -84.44 -24.75 29.4 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.768 0.827 . . . . 0.0 111.851 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -79.8 -32.15 40.76 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 173.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -29.77 69.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.961 0.505 . . . . 0.0 111.698 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.8 ptt180 -65.98 -33.54 76.05 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.502 177.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -69.04 -42.44 76.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.202 0.601 . . . . 0.0 110.095 -179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.4 m -69.64 -41.96 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.519 0.728 . . . . 0.0 111.062 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -68.71 -38.1 85.32 Favored Glycine 0 C--N 1.342 0.901 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.933 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.464 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 35.5 mm -76.77 -38.82 30.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.711 0.405 . . . . 0.0 110.206 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.44 -26.83 68.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.619 0.368 . . . . 0.0 110.757 173.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.5 t -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 92.6 t -59.28 -37.21 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.564 0.746 . . . . 0.0 110.796 175.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 110' ' ' ILE . 7.5 mtpm? -71.27 -33.1 69.47 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.545 0.738 . . . . 0.0 111.026 177.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.42 -51.71 14.17 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.626 0.771 . . . . 0.0 112.558 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -103.77 -4.15 24.02 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.819 0.847 . . . . 0.0 112.267 -173.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.74 -20.52 78.69 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.723 -0.217 . . . . 0.0 113.056 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.603 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 13.8 t -81.24 3.58 23.36 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.599 0.759 . . . . 0.0 111.596 176.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.0 t -89.93 169.3 11.34 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.766 0.426 . . . . 0.0 110.696 178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -123.35 11.09 9.3 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.797 0.839 . . . . 0.0 111.3 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.407 HG22 ' HA ' ' A' ' 20' ' ' TRP . 6.2 t -74.46 80.94 1.93 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-O 121.739 0.781 . . . . 0.0 111.53 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 27.7 m -97.49 124.69 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.357 0.663 . . . . 0.0 110.499 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.424 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 3.7 mptp? -96.29 82.12 3.39 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 171.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 7.1 p-10 -72.56 96.77 2.01 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.021 0.915 . . . . 0.0 109.025 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -93.42 8.8 39.12 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.783 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 42.6 p . . . . . 0 CA--C 1.547 0.853 0 C-N-CA 124.411 1.084 . . . . 0.0 110.095 174.386 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.607 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.437 ' HA ' HG22 ' A' ' 121' ' ' THR . 48.5 p90 -161.35 153.16 19.38 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.608 0.763 . . . . 0.0 110.786 -173.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.472 ' HB2' HG21 ' A' ' 122' ' ' VAL . 97.5 m-85 -88.51 156.74 18.92 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.463 0.705 . . . . 0.0 109.391 169.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -138.58 107.67 6.04 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' A' ' 33' ' ' PHE . 37.7 tp -95.46 101.12 12.81 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.344 0.658 . . . . 0.0 109.571 -177.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.3 t -116.84 -177.74 3.27 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 123.629 0.771 . . . . 0.0 109.022 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -141.39 161.27 38.31 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -82.95 177.36 8.66 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.18 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.8 m -70.64 -22.36 62.52 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.132 0.573 . . . . 0.0 110.184 172.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.28 -5.22 48.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.841 0.856 . . . . 0.0 111.851 171.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 69.78 27.15 4.67 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.984 1.314 . . . . 0.0 111.698 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -87.15 119.66 27.61 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -88.61 142.26 27.84 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.74 0.816 . . . . 0.0 109.314 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HD2' HD22 ' A' ' 48' ' ' LEU . 58.8 ttt180 -157.43 117.37 3.41 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 -171.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 23' ' ' LEU . 46.9 p90 -98.82 133.06 43.67 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG13 HG22 ' A' ' 45' ' ' THR . 17.7 m -107.78 130.76 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.687 0.795 . . . . 0.0 109.05 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.4 tp -100.67 117.57 35.06 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -120.37 142.01 49.56 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.591 1.157 . . . . 0.0 109.516 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.34 -175.92 0.87 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.067 0.947 . . . . 0.0 111.677 173.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.98 -21.76 63.94 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 -176.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -84.34 -4.3 58.79 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.644 0.777 . . . . 0.0 112.533 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.84 8.4 87.71 Favored Glycine 0 C--N 1.343 0.943 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -82.42 132.15 35.21 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.729 0.812 . . . . 0.0 109.423 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.3 m -64.97 123.76 20.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.358 0.663 . . . . 0.0 112.007 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.5 HD13 ' HG ' ' A' ' 35' ' ' LEU . 29.9 pt -105.85 -14.45 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.141 0.976 . . . . 0.0 110.401 172.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 11.6 tp -165.59 144.49 6.26 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.795 0.838 . . . . 0.0 109.002 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.421 HG22 HG13 ' A' ' 34' ' ' VAL . 26.9 m -152.19 114.01 4.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.956 0.903 . . . . 0.0 109.221 176.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.408 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 5.3 m -64.26 170.17 3.99 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.212 1.005 . . . . 0.0 112.014 -177.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.65 174.63 11.39 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.888 0.375 . . . . 0.0 110.21 175.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.416 HD22 ' HD2' ' A' ' 32' ' ' ARG . 66.6 mt -71.71 113.66 8.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.183 0.593 . . . . 0.0 109.748 177.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -90.02 137.4 32.37 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.393 0.677 . . . . 0.0 109.998 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.9 t -69.16 -21.49 63.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.225 0.61 . . . . 0.0 111.624 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p -149.68 156.7 42.32 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.777 0.831 . . . . 0.0 110.371 -174.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -66.94 -28.82 68.6 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 177.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.9 p -59.0 -39.86 83.1 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 123.982 0.801 . . . . 0.0 110.79 176.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.9 m -71.85 -30.05 65.04 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.715 0.806 . . . . 0.0 111.383 177.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.67 -39.06 64.7 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.216 0.606 . . . . 0.0 110.986 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.73 -34.96 72.43 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.881 0.872 . . . . 0.0 110.058 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -62.07 -44.0 97.62 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.367 1.067 . . . . 0.0 109.74 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.84 -49.37 78.67 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.227 0.955 . . . . 0.0 113.042 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.547 ' HA ' HG21 ' A' ' 62' ' ' VAL . 14.9 tt -72.78 -33.83 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 122.297 0.239 . . . . 0.0 111.364 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.8 -32.07 73.39 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.901 0.48 . . . . 0.0 110.934 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.5 m -75.92 -45.45 35.1 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.509 176.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.547 HG21 ' HA ' ' A' ' 59' ' ' ILE . 24.1 m -66.66 -36.62 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 118.005 0.366 . . . . 0.0 111.185 -175.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.09 73.53 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.337 0.589 . . . . 0.0 110.142 -177.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.6 t -77.33 -32.7 55.39 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.973 0.909 . . . . 0.0 110.372 177.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.57 10.7 40.88 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.698 0.799 . . . . 0.0 111.385 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.552 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.6 m -58.76 -46.82 99.54 Favored Pre-proline 0 N--CA 1.484 1.251 0 C-N-CA 123.391 0.676 . . . . 0.0 112.618 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.18 -13.07 15.63 Favored 'Trans proline' 0 C--N 1.391 2.782 0 C-N-CA 121.559 1.506 . . . . 0.0 113.124 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -82.71 77.64 9.43 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -178.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.418 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 0.4 OUTLIER -64.45 -20.66 66.31 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.979 -177.861 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -67.05 -37.89 84.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.767 0.827 . . . . 0.0 110.923 174.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -71.01 -23.61 62.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.273 0.629 . . . . 0.0 111.679 178.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 67.8 m-85 -71.63 115.33 10.69 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 164.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.468 ' HB3' HD21 ' A' ' 85' ' ' ASN . 36.8 tt0 -97.23 117.76 32.16 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.097 0.959 . . . . 0.0 108.865 -173.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.532 ' H ' ' HD2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.72 105.36 4.99 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 110.633 -174.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -100.18 115.32 29.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.325 1.05 . . . . 0.0 109.52 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.0 m -112.75 111.44 22.23 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.44 ' HB2' ' HB2' ' A' ' 81' ' ' LYS . . . -69.37 153.04 44.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.393 173.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 p -61.82 -21.29 64.5 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.826 0.85 . . . . 0.0 111.573 175.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -84.03 11.51 7.8 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.821 0.848 . . . . 0.0 111.493 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.48 17.25 77.71 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 113.236 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.545 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 75.5 mmtt -84.25 123.12 29.8 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -102.8 124.14 47.77 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.466 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 8.1 p90 -152.81 177.94 10.18 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.955 1.302 . . . . 0.0 108.467 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.56 157.41 44.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.507 0.323 . . . . 0.0 111.329 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.468 HD21 ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -135.61 129.97 33.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.112 0.565 . . . . 0.0 110.183 168.033 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.758 HD22 HD13 ' A' ' 94' ' ' ILE . 1.6 tt -81.07 115.23 20.41 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -94.11 137.59 33.13 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.805 0.842 . . . . 0.0 109.794 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -93.95 175.85 6.56 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.004 0.922 . . . . 0.0 110.74 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.73 -23.41 66.74 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.77 0.828 . . . . 0.0 111.474 175.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -84.57 5.24 28.53 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.216 1.007 . . . . 0.0 111.566 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 66.95 10.46 7.67 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.087 1.355 . . . . 0.0 112.238 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.17 148.64 23.54 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.094 0.557 . . . . 0.0 110.558 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.501 HG22 ' HB2' ' A' ' 96' ' ' SER . 54.9 mt -78.22 99.99 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 170.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.758 HD13 HD22 ' A' ' 86' ' ' LEU . 14.3 pt -81.26 -6.75 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.222 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.408 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -179.58 121.31 0.73 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-O 119.345 -0.697 . . . . 0.0 111.812 173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.501 ' HB2' HG22 ' A' ' 93' ' ' ILE . 23.1 t -119.31 113.71 21.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.858 0.863 . . . . 0.0 110.468 177.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 44' ' ' LEU . 32.5 t -65.29 161.14 20.11 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.762 0.825 . . . . 0.0 111.372 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -88.95 163.46 15.56 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.296 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.545 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 17.6 ptt? -73.14 120.68 19.09 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.388 0.675 . . . . 0.0 111.668 -173.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -101.11 157.12 17.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.208 173.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.46 -46.0 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.837 0.455 . . . . 0.0 111.277 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.5 p -101.45 153.74 19.43 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 123.27 0.628 . . . . 0.0 110.88 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.41 82.44 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.888 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -59.56 -29.94 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.417 0.687 . . . . 0.0 112.763 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.2 m -71.56 -40.48 69.95 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 112.073 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.444 ' O ' HG12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -76.21 -26.83 56.51 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.395 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -65.89 -43.13 89.14 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 122.983 0.513 . . . . 0.0 110.138 172.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.7 m -63.6 -33.9 76.63 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.897 171.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.34 -40.0 98.44 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.944 0.777 . . . . 0.0 113.247 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 106' ' ' ARG . 44.5 mm -60.04 -46.22 94.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-O 121.213 0.53 . . . . 0.0 109.741 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.92 78.9 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.52 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.4 t -71.8 -43.27 65.95 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.147 0.579 . . . . 0.0 110.455 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.3 t -73.56 -24.72 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.43 0.692 . . . . 0.0 110.56 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.552 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.7 OUTLIER -62.47 -45.88 91.04 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 172.682 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.41 -50.15 16.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.998 -175.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -84.17 -26.9 28.45 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.154 0.982 . . . . 0.0 111.178 -172.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . 0.439 ' HA2' ' HZ ' ' A' ' 21' ' ' PHE . . . -65.41 -43.2 95.31 Favored Glycine 0 C--N 1.346 1.114 0 O-C-N 123.613 0.571 . . . . 0.0 112.797 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 46.6 p -68.56 -27.7 66.31 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.586 0.754 . . . . 0.0 111.76 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -75.28 121.81 22.75 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.425 0.69 . . . . 0.0 110.15 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.04 43.34 1.14 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.368 1.067 . . . . 0.0 111.159 -174.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.437 HG22 ' HA ' ' A' ' 20' ' ' TRP . 2.6 t -95.36 111.93 23.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.108 0.963 . . . . 0.0 108.847 176.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 21' ' ' PHE . 27.0 t -134.73 135.33 53.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.245 0.618 . . . . 0.0 110.044 -174.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -91.38 95.31 9.92 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 166.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -75.12 95.03 3.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.689 0.757 . . . . 0.0 109.292 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -107.31 27.35 9.17 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.581 -1.191 . . . . 0.0 110.393 -178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 45.3 p . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 123.669 0.788 . . . . 0.0 110.814 -177.617 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.652 0 N-CA-C 112.033 -0.427 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -146.1 157.38 43.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.167 0.987 . . . . 0.0 109.581 -177.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -99.5 151.31 21.28 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.468 0.707 . . . . 0.0 110.015 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.456 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 48.3 mt-10 -137.29 115.05 11.33 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.431 1.092 . . . . 0.0 108.5 171.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.6 tp -80.45 98.41 7.52 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.3 p -94.09 155.06 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.343 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 12.5 ptmm? -113.65 165.81 12.16 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.495 0.718 . . . . 0.0 109.285 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -102.27 -178.94 3.84 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.055 0.542 . . . . 0.0 109.955 174.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.4 t -65.9 -27.21 68.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.032 0.533 . . . . 0.0 110.351 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.24 2.87 22.75 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.78 0.832 . . . . 0.0 111.728 174.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.412 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 12.3 t30 70.35 9.64 7.03 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.876 1.27 . . . . 0.0 111.477 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -74.63 131.48 40.95 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.153 0.581 . . . . 0.0 109.997 -177.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -92.58 137.63 32.2 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.03 0.932 . . . . 0.0 110.384 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -155.65 141.6 18.18 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -103.24 136.82 42.3 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.7 m -107.36 132.82 53.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 175.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.488 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.7 tp -100.22 114.98 28.82 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 171.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.54 141.61 35.71 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.395 1.078 . . . . 0.0 108.897 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.27 175.46 10.63 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.038 0.535 . . . . 0.0 110.201 171.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.94 -7.45 56.09 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 113.914 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -73.17 -18.37 61.28 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.001 0.92 . . . . 0.0 111.053 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.61 -7.51 74.47 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.413 -173.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -88.48 136.91 32.76 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.095 0.958 . . . . 0.0 110.176 -177.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.7 m -75.78 121.41 22.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.014 0.526 . . . . 0.0 109.786 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.39 -25.14 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.898 0.879 . . . . 0.0 110.839 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.488 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.0 tp -148.01 143.6 27.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.218 0.607 . . . . 0.0 109.963 -171.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.8 m -149.81 129.93 13.58 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.197 0.999 . . . . 0.0 108.806 175.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.4 p -78.6 170.85 16.0 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.134 0.573 . . . . 0.0 111.024 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HB3' ' HB ' ' A' ' 93' ' ' ILE . 7.9 pt-20 -70.17 170.15 12.17 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.078 0.551 . . . . 0.0 111.049 175.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.25 112.12 13.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -92.79 142.06 27.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.061 0.945 . . . . 0.0 109.761 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.7 p -72.51 -25.93 61.58 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.295 0.638 . . . . 0.0 111.022 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.5 m -124.42 138.43 54.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.926 0.89 . . . . 0.0 110.153 -175.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -67.47 -28.12 67.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.858 0.463 . . . . 0.0 110.475 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.5 p -57.67 -40.77 80.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.161 0.984 . . . . 0.0 110.985 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -65.93 -35.14 79.78 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.917 0.887 . . . . 0.0 111.127 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.3 -33.15 61.17 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.44 0.696 . . . . 0.0 111.411 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -69.86 -43.54 71.66 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.631 0.773 . . . . 0.0 110.195 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.13 -22.45 52.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.58 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.18 75.69 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.708 0.63 . . . . 0.0 112.622 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.449 ' HA ' HG21 ' A' ' 62' ' ' VAL . 6.1 tt -67.48 -33.07 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 122.699 0.4 . . . . 0.0 110.795 176.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.81 82.32 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.107 0.479 . . . . 0.0 110.346 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -76.09 -39.64 54.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.355 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.449 HG21 ' HA ' ' A' ' 59' ' ' ILE . 19.9 m -64.59 -33.11 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 CA-C-N 119.204 0.911 . . . . 0.0 110.495 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -70.6 -39.4 73.81 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 124.265 0.978 . . . . 0.0 110.624 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.8 t -74.14 -30.72 62.43 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.539 0.736 . . . . 0.0 110.841 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -107.55 18.35 21.59 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.786 0.835 . . . . 0.0 111.256 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.605 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 55.5 m -59.81 -49.63 90.66 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 123.398 0.679 . . . . 0.0 111.762 168.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.66 -4.65 12.97 Favored 'Trans proline' 0 C--N 1.398 3.165 0 C-N-CA 121.968 1.779 . . . . 0.0 113.098 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -92.67 81.7 4.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.965 0.506 . . . . 0.0 110.126 -173.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.55 -29.99 59.97 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 124.52 1.128 . . . . 0.0 112.265 176.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -63.26 -35.39 80.2 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.164 1.386 . . . . 0.0 110.514 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -76.14 -23.11 54.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.609 0.764 . . . . 0.0 112.117 -176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -73.91 138.63 44.4 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.442 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 73.3 mm-40 -98.97 95.34 7.08 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.7 103.68 15.38 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 56.7 mttm -124.5 157.3 35.62 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 109.348 -175.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.5 m -127.23 115.54 19.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.644 0.778 . . . . 0.0 109.563 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.23 159.7 5.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.162 0.985 . . . . 0.0 111.83 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.6 p -57.69 -27.0 62.51 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.328 1.051 . . . . 0.0 112.806 -174.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -88.83 16.53 6.71 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 112.109 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.77 31.83 62.03 Favored Glycine 0 C--N 1.35 1.339 0 CA-C-N 116.372 -0.376 . . . . 0.0 113.335 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.7 mmtt -101.41 122.1 43.14 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.082 0.553 . . . . 0.0 109.848 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -95.2 130.86 41.76 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.484 0.714 . . . . 0.0 109.491 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.455 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 45.6 p90 -149.37 161.44 42.06 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.302 0.641 . . . . 0.0 109.616 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.42 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 42.2 p90 -130.91 135.9 48.1 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.206 0.602 . . . . 0.0 109.865 176.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.64 117.21 31.65 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 172.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.578 HD22 HD11 ' A' ' 94' ' ' ILE . 0.8 OUTLIER -76.68 109.38 10.4 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.337 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -90.22 137.67 32.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.857 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -100.01 154.69 18.19 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.522 0.729 . . . . 0.0 109.19 169.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.03 -16.44 61.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -74.8 1.85 11.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.474 1.11 . . . . 0.0 111.993 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.0 m170 68.6 14.71 9.08 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.238 1.415 . . . . 0.0 111.428 -177.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -103.86 140.86 37.09 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.308 0.643 . . . . 0.0 109.632 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.412 ' HB ' ' HB3' ' A' ' 47' ' ' GLU . 51.2 mm -80.13 98.39 3.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.996 0.919 . . . . 0.0 108.877 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.578 HD11 HD22 ' A' ' 86' ' ' LEU . 24.7 pt -81.99 -12.9 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.511 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.69 142.17 8.51 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 t -153.55 165.29 36.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.645 0.778 . . . . 0.0 109.63 175.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 t -143.7 148.76 36.2 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.4 ' NE2' ' HG2' ' A' ' 99' ' ' MET . 0.0 OUTLIER -68.93 -42.61 76.54 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.715 0.635 . . . . 0.0 110.483 -175.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.461 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 27.7 ptt? 176.24 155.08 0.21 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.425 1.49 . . . . 0.0 108.632 171.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -103.59 128.68 50.82 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 165.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.58 98.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.914 0.886 . . . . 0.0 111.587 -173.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 p -111.81 146.59 37.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.097 0.959 . . . . 0.0 110.425 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -75.33 -16.66 60.39 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.637 0.775 . . . . 0.0 111.797 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.66 -33.37 62.49 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.399 0.68 . . . . 0.0 110.384 173.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.1 t -67.88 -20.08 65.09 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 17.2 ptt180 -55.99 -37.85 69.67 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 122.915 0.486 . . . . 0.0 110.97 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.18 -39.31 71.93 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.339 1.056 . . . . 0.0 110.127 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.82 -40.12 96.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.142 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.73 -47.04 70.05 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.888 -178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 43.1 mm -59.38 -45.16 93.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 122.785 0.434 . . . . 0.0 109.963 176.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.35 86.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.579 0.751 . . . . 0.0 111.423 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.2 t -76.05 -38.27 57.33 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.163 0.585 . . . . 0.0 111.058 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.32 -34.58 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.384 0.673 . . . . 0.0 110.538 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.605 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.9 OUTLIER -69.17 -48.66 61.62 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.48 0.712 . . . . 0.0 109.963 178.551 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.425 ' O ' HG21 ' A' ' 118' ' ' THR . . . -70.26 -51.28 31.81 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.142 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -83.53 0.21 47.51 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.453 0.701 . . . . 0.0 111.96 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.94 -30.97 72.23 Favored Glycine 0 C--N 1.347 1.147 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.425 HG21 ' O ' ' A' ' 115' ' ' ALA . 11.5 t -85.23 0.78 50.78 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.786 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.1 m -67.15 108.87 2.83 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 122.905 0.482 . . . . 0.0 110.214 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -73.33 -14.61 61.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.746 0.418 . . . . 0.0 111.462 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.4 t -66.04 103.55 0.97 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.571 0.748 . . . . 0.0 110.282 176.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.51 122.37 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 123.867 0.867 . . . . 0.0 110.064 177.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.456 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 22.1 mtpp -83.05 148.36 27.59 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.078 173.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -106.24 94.83 5.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -81.89 -10.98 59.13 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.841 0.856 . . . . 0.0 111.152 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.421 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 37.8 p . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 124.363 1.065 . . . . 0.0 112.261 -174.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.364 -0.294 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.9 m -95.27 157.35 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.837 0.855 . . . . 0.0 110.917 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.2 pt -69.87 123.85 24.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 123.118 0.567 . . . . 0.0 110.536 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -86.47 146.05 26.57 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.57 90.26 2.82 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.27 -169.65 22.89 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.265 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.1 p90 -160.03 150.13 18.39 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.195 0.522 . . . . 0.0 111.027 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -94.32 149.35 21.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.178 0.991 . . . . 0.0 108.598 170.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.548 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.6 mt-10 -131.37 109.5 10.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 171.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.5 tp -87.16 107.98 18.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.5 t -122.62 142.96 50.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.935 0.894 . . . . 0.0 109.045 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -94.7 139.65 30.95 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 171.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.0 m -76.38 -175.54 3.29 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 0.0 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.6 t -61.16 -25.78 67.25 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.062 0.545 . . . . 0.0 111.181 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -95.63 16.16 18.01 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.053 0.941 . . . . 0.0 110.787 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 64.06 17.62 10.73 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.261 1.424 . . . . 0.0 112.992 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.466 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 86.5 mm-40 -82.5 127.49 33.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.529 0.731 . . . . 0.0 110.724 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -85.89 122.11 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.836 0.854 . . . . 0.0 109.076 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -147.39 120.39 8.79 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 124.171 0.989 . . . . 0.0 108.556 -172.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -99.18 137.9 37.04 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.3 m -107.53 131.72 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.6 tp -91.36 123.49 34.82 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -115.7 149.76 37.89 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 109.172 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.54 -173.75 4.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.313 1.045 . . . . 0.0 110.275 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -57.34 -34.6 68.38 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 114.509 0.564 . . . . 0.0 114.509 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -88.66 8.1 30.26 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.623 0.769 . . . . 0.0 112.005 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 6.43 89.3 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.797 -0.183 . . . . 0.0 113.302 -176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.85 110.06 4.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 110.424 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -65.08 121.37 14.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 pt -114.38 -20.78 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.61 1.164 . . . . 0.0 110.897 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -147.81 146.52 29.17 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.9 m -145.78 118.12 8.44 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.745 0.818 . . . . 0.0 108.936 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 98.1 p -69.21 170.19 10.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.748 0.419 . . . . 0.0 110.871 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.84 175.15 10.32 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 121.358 0.599 . . . . 0.0 110.895 174.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 89.0 mt -75.67 113.03 12.65 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.86 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.533 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 66.6 m-85 -100.97 133.61 45.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.685 0.794 . . . . 0.0 109.319 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.3 m -68.34 -25.56 65.16 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.155 0.582 . . . . 0.0 111.059 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -130.05 147.09 51.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.474 0.71 . . . . 0.0 110.981 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -27.8 68.77 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.781 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.8 p -57.63 -36.69 72.15 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.815 0.846 . . . . 0.0 111.782 175.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.533 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 13.2 m -69.8 -33.03 71.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.605 0.762 . . . . 0.0 110.752 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.67 59.89 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.531 0.732 . . . . 0.0 111.503 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -69.39 -45.26 69.72 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.288 0.635 . . . . 0.0 109.759 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -71.29 -24.72 62.2 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.81 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.405 ' O ' HG12 ' A' ' 62' ' ' VAL . . . -64.14 -51.13 55.64 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.531 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.8 tt -71.39 -34.29 53.06 Favored 'Isoleucine or valine' 0 C--N 1.357 0.911 0 CA-C-N 116.641 0.221 . . . . 0.0 111.02 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.72 86.25 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.245 0.545 . . . . 0.0 110.275 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.6 m -74.17 -43.67 56.41 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.365 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.531 HG21 ' HA ' ' A' ' 59' ' ' ILE . 13.2 m -65.05 -29.23 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-N 119.046 0.839 . . . . 0.0 111.036 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -76.02 -35.44 59.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.041 0.536 . . . . 0.0 110.277 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -77.83 -31.77 51.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.462 0.705 . . . . 0.0 110.844 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -101.92 12.13 37.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.752 0.821 . . . . 0.0 110.9 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.9 t -64.35 -48.93 74.68 Favored Pre-proline 0 CA--C 1.559 1.325 0 C-N-CA 123.919 0.888 . . . . 0.0 111.285 174.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -78.99 -9.52 15.47 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 121.744 1.629 . . . . 0.0 112.733 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -84.92 81.22 8.99 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -59.68 -28.09 66.98 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.377 1.071 . . . . 0.0 112.256 -177.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -78.54 -23.88 45.97 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' NE ' ' HB2' ' A' ' 87' ' ' LYS . 6.5 tpm_? -75.5 -21.9 57.62 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 111.435 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -70.48 133.51 46.88 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 169.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.488 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 43.5 mm-40 -96.18 97.11 9.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -78.31 103.63 8.38 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -122.4 159.49 27.44 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.872 1.269 . . . . 0.0 110.056 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.5 m -128.26 115.94 19.09 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.443 0.697 . . . . 0.0 109.732 174.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.18 156.47 31.66 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.802 0.841 . . . . 0.0 111.342 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.4 m -67.08 -10.8 53.82 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 124.028 0.931 . . . . 0.0 111.811 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.86 4.9 17.66 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 123.902 0.881 . . . . 0.0 110.083 172.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 34.13 67.87 Favored Glycine 0 C--N 1.352 1.434 0 C-N-CA 123.206 0.432 . . . . 0.0 112.731 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.6 mmtt -114.32 124.52 52.2 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.188 0.595 . . . . 0.0 110.211 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.489 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 77.4 m-85 -91.78 125.79 36.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.308 0.643 . . . . 0.0 109.876 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.625 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 25.3 p90 -146.66 174.75 11.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.244 1.018 . . . . 0.0 108.921 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.488 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 44.9 p90 -145.0 135.49 24.29 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.786 0.326 . . . . 0.0 111.345 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.523 ' HB3' HD12 ' A' ' 93' ' ' ILE . 6.1 m-20 -112.48 114.88 27.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.589 0.756 . . . . 0.0 109.328 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 41.5 tp -80.23 119.06 22.48 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.432 ' HB2' ' NE ' ' A' ' 71' ' ' ARG . 34.0 mmtp -87.11 156.85 19.55 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.009 0.924 . . . . 0.0 111.27 -177.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.6 175.14 5.6 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.227 167.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.39 -28.25 69.86 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.525 0.678 . . . . 0.0 110.63 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -81.91 10.81 5.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.456 1.103 . . . . 0.0 112.153 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 66.59 4.89 3.54 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.78 1.232 . . . . 0.0 111.983 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -85.38 140.83 30.45 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.771 0.828 . . . . 0.0 110.427 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.523 HD12 ' HB3' ' A' ' 85' ' ' ASN . 20.5 mm -76.14 99.67 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 14.2 pt -79.44 -11.37 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.019 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.38 108.2 0.26 Allowed Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.3 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.425 ' HB3' HG21 ' A' ' 93' ' ' ILE . 77.8 p -92.01 134.54 34.72 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -88.39 160.32 17.63 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.169 0.509 . . . . 0.0 109.855 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.82 141.42 48.01 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.865 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.625 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.1 ptt? -73.47 116.51 14.13 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.413 0.625 . . . . 0.0 109.645 -176.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -93.35 158.32 15.8 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.252 -176.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 -54.68 7.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 122.567 0.347 . . . . 0.0 110.453 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 p -97.36 155.85 16.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.371 0.668 . . . . 0.0 111.782 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -70.49 -33.54 71.34 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.641 0.777 . . . . 0.0 110.895 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -63.08 -32.19 73.51 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.004 0.522 . . . . 0.0 111.292 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -71.48 -30.1 65.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.432 0.693 . . . . 0.0 110.662 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 57.5 ttp180 -69.77 -38.73 76.85 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.319 0.648 . . . . 0.0 109.949 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 22.3 mm-40 -71.14 -40.08 71.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.244 0.618 . . . . 0.0 110.986 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.4 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.466 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.94 -44.63 97.56 Favored Glycine 0 C--N 1.347 1.18 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.471 174.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.93 -46.44 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.435 0.694 . . . . 0.0 109.961 176.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.48 80.23 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.923 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.5 t -76.0 -44.15 40.89 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.993 0.517 . . . . 0.0 110.451 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 87.5 t -68.57 -27.78 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.004 0.522 . . . . 0.0 110.229 177.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -69.89 -37.83 76.16 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.002 0.521 . . . . 0.0 110.706 173.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.22 -51.06 16.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.448 0.699 . . . . 0.0 111.74 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -89.28 -13.95 36.92 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 111.14 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.81 -20.71 70.23 Favored Glycine 0 C--N 1.349 1.255 0 CA-C-N 116.473 -0.33 . . . . 0.0 113.164 178.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.6 p -72.19 -10.87 60.36 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.915 0.486 . . . . 0.0 111.263 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.7 t -84.02 172.91 11.59 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.681 0.792 . . . . 0.0 110.179 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -148.29 24.94 1.01 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.782 0.833 . . . . 0.0 109.064 175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -73.94 83.0 1.71 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.589 0.756 . . . . 0.0 110.794 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 47.1 t -89.53 120.63 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.722 0.809 . . . . 0.0 110.617 -176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.548 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 68.3 mttm -93.04 113.54 25.83 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.392 1.077 . . . . 0.0 108.708 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.13 96.1 2.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.766 0.794 . . . . 0.0 109.938 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -92.27 -7.77 47.14 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.849 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.3 p -60.18 159.21 10.06 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.373 1.069 . . . . 0.0 111.178 172.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 98.82 19.69 21.34 Favored Glycine 0 N--CA 1.47 0.952 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.446 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 41.8 t -82.28 112.87 19.66 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.185 0.594 . . . . 0.0 109.695 174.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 123.558 0.743 . . . . 0.0 109.021 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 112.174 -0.371 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.2 m -100.48 143.49 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.672 0.789 . . . . 0.0 109.945 175.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.8 pt -73.69 99.02 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-O 121.623 0.725 . . . . 0.0 109.513 173.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 56.2 mtm -81.6 96.5 7.5 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.792 -177.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.88 74.68 1.49 Allowed 'General case' 0 C--O 1.239 0.537 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 168.61 155.61 9.75 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 116.079 -0.509 . . . . 0.0 113.176 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -140.1 158.38 44.15 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.877 1.271 . . . . 0.0 109.526 -176.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.453 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 66.2 m-85 -98.85 146.94 25.43 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.636 0.775 . . . . 0.0 109.43 173.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -133.55 111.57 10.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.619 0.768 . . . . 0.0 109.122 174.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -80.3 95.94 6.49 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 173.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -104.27 -177.38 3.35 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.003 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.499 ' HE3' ' HA ' ' A' ' 29' ' ' ASN . 22.0 ptmt -135.01 146.45 49.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.136 0.574 . . . . 0.0 109.657 174.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.4 m -78.12 169.72 17.8 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.54 0.736 . . . . 0.0 110.344 170.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.52 -10.98 59.12 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.101 0.56 . . . . 0.0 111.177 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -86.87 8.58 22.36 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.059 0.943 . . . . 0.0 111.569 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.499 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 42.3 m-80 69.46 7.94 6.5 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.482 1.513 . . . . 0.0 112.88 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.455 ' HB2' HD13 ' A' ' 48' ' ' LEU . 11.6 mm-40 -84.74 137.59 33.12 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.001 0.52 . . . . 0.0 110.086 -178.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -91.72 134.05 35.06 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.978 0.911 . . . . 0.0 109.854 -172.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -152.87 141.26 20.65 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.625 0.77 . . . . 0.0 108.967 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -98.59 141.06 31.91 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.522 HG12 HG21 ' A' ' 45' ' ' THR . 28.8 m -113.04 133.37 59.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 172.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.5 OUTLIER -88.0 108.04 19.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 167.645 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.546 ' HZ3' ' HB2' ' A' ' 36' ' ' LYS . 4.3 ttmp? -111.54 114.86 28.22 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.155 0.982 . . . . 0.0 109.657 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.42 173.21 2.17 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.173 0.989 . . . . 0.0 112.602 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.15 -15.91 61.47 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.511 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -74.83 -6.06 46.95 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.059 0.944 . . . . 0.0 111.671 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.74 14.94 80.34 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -117.36 137.45 52.45 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.049 0.94 . . . . 0.0 109.97 -177.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 60.8 m -76.82 121.64 23.66 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.364 0.666 . . . . 0.0 110.401 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.5 pt -89.49 -19.84 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.008 0.923 . . . . 0.0 110.843 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 tp -159.89 118.37 2.73 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -172.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.522 HG21 HG12 ' A' ' 34' ' ' VAL . 55.4 m -111.31 127.35 55.61 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.457 0.703 . . . . 0.0 109.377 175.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.9 t -81.56 170.2 16.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.603 0.361 . . . . 0.0 111.13 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -83.22 -175.77 5.99 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.455 HD13 ' HB2' ' A' ' 30' ' ' GLN . 2.5 mm? -85.5 113.62 21.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.753 -172.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.429 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 75.8 m-85 -107.26 119.58 39.8 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.825 0.85 . . . . 0.0 108.721 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 81.4 p -61.71 -33.48 74.1 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.561 0.744 . . . . 0.0 111.644 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -113.75 135.8 53.55 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.095 0.958 . . . . 0.0 109.092 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.32 -28.15 67.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.452 0.701 . . . . 0.0 111.126 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.8 p -57.39 -36.21 70.98 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.074 0.95 . . . . 0.0 111.698 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.429 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 24.9 m -71.45 -28.85 64.25 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.252 0.621 . . . . 0.0 111.407 177.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.56 -32.11 57.96 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.608 0.763 . . . . 0.0 111.29 173.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -73.4 -34.07 65.32 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.597 0.759 . . . . 0.0 110.577 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -78.09 -26.34 48.06 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.701 170.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.39 -41.91 94.19 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.361 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.509 ' HA ' HG21 ' A' ' 62' ' ' VAL . 11.0 tt -71.99 -32.41 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 175.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.22 -32.91 74.42 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.752 0.421 . . . . 0.0 110.738 172.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.2 m -69.3 -53.74 18.18 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.381 176.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.509 HG21 ' HA ' ' A' ' 59' ' ' ILE . 16.4 m -63.9 -29.1 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 123.047 0.217 . . . . 0.0 111.269 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -55.85 17.6 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.827 0.851 . . . . 0.0 108.728 178.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.9 t -66.52 -23.6 66.26 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.333 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.19 4.7 46.84 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.962 0.905 . . . . 0.0 112.28 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.1 m -66.76 -48.12 53.51 Favored Pre-proline 0 CA--C 1.565 1.531 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.254 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.95 -16.1 23.23 Favored 'Trans proline' 0 C--N 1.398 3.134 0 C-N-CA 121.814 1.676 . . . . 0.0 112.728 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -84.63 99.84 11.05 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.211 0.604 . . . . 0.0 110.394 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.67 -23.42 65.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.929 0.891 . . . . 0.0 112.535 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -73.3 -30.18 63.21 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.149 0.979 . . . . 0.0 110.615 -176.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -75.97 -12.04 60.07 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.41 0.684 . . . . 0.0 112.055 -171.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -129.17 145.77 51.24 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.579 0.351 . . . . 0.0 110.282 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 36.8 tt0 -130.7 147.24 52.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.531 0.732 . . . . 0.0 109.875 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.06 112.57 5.76 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 74.7 mmtt -111.9 142.04 44.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.666 0.787 . . . . 0.0 111.459 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 55.4 m -123.55 117.63 25.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.452 0.701 . . . . 0.0 109.352 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.04 168.4 6.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.375 1.07 . . . . 0.0 112.232 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.3 m -64.56 -24.45 67.6 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.223 1.009 . . . . 0.0 112.079 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.444 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 14.7 m120 -89.21 9.78 24.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 0.0 111.337 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.0 5.43 89.74 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 116.499 -0.318 . . . . 0.0 113.326 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.444 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 73.2 mmtt -73.36 152.56 40.82 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.473 0.709 . . . . 0.0 110.311 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.41 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 92.7 m-85 -113.27 126.73 55.73 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.303 0.641 . . . . 0.0 109.989 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.83 -179.92 8.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.066 1.346 . . . . 0.0 108.295 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -139.38 172.26 13.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.989 -0.444 . . . . 0.0 109.948 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -145.31 141.9 28.96 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.669 0.388 . . . . 0.0 110.489 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.59 140.11 31.69 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.929 0.892 . . . . 0.0 109.214 177.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -121.78 158.83 27.96 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.66 1.584 . . . . 0.0 110.247 -172.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -128.63 -176.48 3.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.831 0.852 . . . . 0.0 110.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.44 -22.02 66.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.721 0.808 . . . . 0.0 111.625 175.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -73.24 -16.72 61.4 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.522 1.129 . . . . 0.0 111.315 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 m80 67.15 14.68 9.86 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.324 1.45 . . . . 0.0 111.025 -167.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -88.36 161.76 16.93 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.493 0.717 . . . . 0.0 110.269 177.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.3 mm -84.66 104.08 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.948 -1.023 . . . . 0.0 108.352 174.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.84 -2.33 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.005 0.522 . . . . 0.0 110.471 173.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.59 146.49 8.88 Favored Glycine 0 C--N 1.341 0.851 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.3 p -156.61 123.48 5.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.173 0.989 . . . . 0.0 108.761 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.9 m -72.43 171.89 11.44 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.315 1.046 . . . . 0.0 112.649 -171.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.41 150.7 38.26 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 171.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.62 115.27 12.83 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -100.66 150.34 22.84 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.65 -31.91 52.94 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.388 0.275 . . . . 0.0 110.971 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.3 p -110.81 148.7 31.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.065 0.546 . . . . 0.0 111.778 -174.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.32 -24.4 61.3 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.421 1.089 . . . . 0.0 112.353 -175.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -68.78 -32.91 72.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.276 0.631 . . . . 0.0 111.54 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.5 m -68.76 -31.38 70.37 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.015 0.526 . . . . 0.0 112.368 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.41 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 38.6 ptt180 -75.99 -39.75 55.19 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 117.421 0.101 . . . . 0.0 110.875 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -76.91 -28.64 55.39 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -66.41 -38.4 87.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 168.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.35 -37.06 92.49 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.748 174.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.9 mm -59.39 -51.44 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.546 0.739 . . . . 0.0 109.572 174.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.79 68.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.671 0.789 . . . . 0.0 111.353 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.3 t -75.52 -33.81 60.75 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.897 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.1 t -70.45 -35.05 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 122.971 0.508 . . . . 0.0 110.235 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.463 ' HZ2' ' HB3' ' A' ' 114' ' ' LYS . 8.0 mtpm? -67.53 -34.27 76.74 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.564 0.746 . . . . 0.0 111.053 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -50.17 8.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.167 0.587 . . . . 0.0 111.294 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -89.22 -1.77 58.21 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.695 0.798 . . . . 0.0 112.208 -170.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.07 -25.12 76.3 Favored Glycine 0 C--N 1.339 0.721 0 CA-C-O 120.144 -0.254 . . . . 0.0 112.747 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.3 t -89.28 -5.96 57.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.481 0.712 . . . . 0.0 111.38 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.0 m -66.03 143.21 57.5 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.956 0.502 . . . . 0.0 110.684 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -111.65 8.21 20.73 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.624 0.769 . . . . 0.0 110.742 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 23.4 m -77.38 91.62 3.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.866 0.867 . . . . 0.0 110.792 -175.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.6 t -104.24 113.05 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.609 0.764 . . . . 0.0 109.827 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.506 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 43.8 mtpt -101.38 110.27 22.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.583 0.753 . . . . 0.0 109.905 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -76.82 94.45 3.88 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-O 122.149 0.976 . . . . 0.0 110.094 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -95.25 7.79 45.08 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 110.707 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.5 p -62.65 92.43 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.715 0.806 . . . . 0.0 111.344 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.63 -24.09 10.58 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.109 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 t -73.66 88.68 1.72 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.599 0.76 . . . . 0.0 110.053 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.5 m120 . . . . . 0 C--O 1.25 1.082 0 C-N-CA 124.752 1.221 . . . . 0.0 108.562 -179.219 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.579 0 N-CA-C 112.001 -0.439 . . . . 0.0 112.001 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -83.5 142.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.126 0.57 . . . . 0.0 110.513 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.1 pt -104.42 127.84 58.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 CA-C-O 121.279 0.561 . . . . 0.0 109.497 175.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 56.7 mtt -85.31 97.57 10.03 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.487 0.715 . . . . 0.0 110.428 -172.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.2 88.23 5.53 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.145 0.978 . . . . 0.0 109.023 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.03 147.56 22.11 Favored Glycine 0 C--N 1.34 0.762 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -170.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -159.72 153.79 23.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.469 0.708 . . . . 0.0 110.276 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -100.03 152.09 20.62 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.932 173.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -133.08 114.66 14.17 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.872 0.869 . . . . 0.0 109.18 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.562 HD22 ' HB2' ' A' ' 52' ' ' LYS . 40.8 tp -80.5 98.32 7.52 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -102.45 179.5 4.28 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.448 1.099 . . . . 0.0 109.306 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -146.48 145.07 30.06 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 168.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.3 m -81.45 -173.35 4.32 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.279 0.632 . . . . 0.0 111.422 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -63.06 -22.6 66.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.799 0.84 . . . . 0.0 111.115 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.26 -16.74 61.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.501 1.12 . . . . 0.0 111.95 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 71.58 11.27 6.49 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.543 1.537 . . . . 0.0 111.795 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -81.14 138.09 35.91 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.526 0.73 . . . . 0.0 109.102 174.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -89.57 138.36 31.53 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 110.33 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -149.5 130.89 14.71 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.118 0.967 . . . . 0.0 108.99 -168.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -90.77 143.49 26.68 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.77 131.64 71.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 166.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.26 110.18 22.41 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -98.39 123.51 42.56 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 171.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.96 178.87 0.75 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.578 0.751 . . . . 0.0 111.478 176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.91 -20.83 54.35 Favored Glycine 0 CA--C 1.54 1.65 0 CA-C-O 121.105 0.28 . . . . 0.0 112.652 172.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.82 -23.29 65.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.367 1.467 . . . . 0.0 111.993 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.16 -3.86 82.58 Favored Glycine 0 C--N 1.35 1.31 0 C-N-CA 123.307 0.48 . . . . 0.0 112.521 -173.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -88.28 134.08 33.89 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.775 1.23 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -71.85 120.53 17.58 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.3 pt -108.3 -25.55 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 125.041 1.337 . . . . 0.0 110.867 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.4 tp -140.32 151.42 45.03 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.286 1.034 . . . . 0.0 108.552 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.0 m -151.01 110.62 4.02 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.097 0.959 . . . . 0.0 108.649 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.458 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 18.8 m -63.57 165.32 8.22 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.314 0.646 . . . . 0.0 110.942 175.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.96 179.82 4.71 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.283 0.563 . . . . 0.0 111.414 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.74 114.75 22.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -106.17 142.39 35.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.197 0.999 . . . . 0.0 109.384 -178.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.0 t -65.52 -26.72 68.03 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.407 0.683 . . . . 0.0 111.454 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -139.41 150.42 45.24 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.01 0.924 . . . . 0.0 109.559 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HB2' HD22 ' A' ' 23' ' ' LEU . 20.3 pttm -62.67 -26.57 68.72 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.613 0.571 . . . . 0.0 110.841 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 82.1 p -50.97 -47.36 61.31 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.091 1.357 . . . . 0.0 112.122 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.2 m -71.71 -26.63 62.57 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.74 . . . . 0.0 111.552 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.75 63.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.616 0.767 . . . . 0.0 110.23 174.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.83 -37.82 76.34 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.097 0.959 . . . . 0.0 110.206 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' A' ' 53' ' ' THR . 29.2 mtpp -66.47 -33.53 75.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.608 170.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.06 -49.78 74.62 Favored Glycine 0 C--N 1.35 1.339 0 O-C-N 124.071 0.857 . . . . 0.0 112.762 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.507 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -70.42 -36.11 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 117.15 0.475 . . . . 0.0 110.9 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.54 -39.33 79.9 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.114 0.483 . . . . 0.0 110.301 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.1 m -74.47 -43.28 56.82 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.858 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.507 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -66.1 -28.79 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 119.11 0.868 . . . . 0.0 110.319 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.4 tpt85 -68.16 -39.23 82.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.678 0.791 . . . . 0.0 109.869 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.7 m -78.35 -24.05 46.65 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.691 0.796 . . . . 0.0 111.509 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -105.32 13.69 30.02 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.107 0.963 . . . . 0.0 111.21 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.9 m -55.93 -45.36 99.91 Favored Pre-proline 0 CA--C 1.569 1.676 0 C-N-CA 123.591 0.756 . . . . 0.0 112.148 172.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -87.93 -14.09 3.63 Favored 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 121.796 1.664 . . . . 0.0 113.951 175.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.38 93.12 4.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.033 0.533 . . . . 0.0 110.769 -170.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.09 -32.37 72.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.948 1.299 . . . . 0.0 112.565 -173.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -68.85 -26.04 64.95 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.551 0.74 . . . . 0.0 111.041 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -77.06 -26.05 53.13 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.572 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HB3' HD13 ' A' ' 110' ' ' ILE . 95.9 m-85 -82.58 97.12 8.31 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 171.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -110.28 146.42 35.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.83 0.452 . . . . 0.0 109.888 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -87.01 149.32 24.84 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.798 1.239 . . . . 0.0 109.469 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -155.77 129.15 8.28 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.209 0.603 . . . . 0.0 109.857 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 48.2 m -92.27 121.42 33.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.954 0.502 . . . . 0.0 109.658 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 160.98 6.24 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.248 1.019 . . . . 0.0 111.908 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.2 t -72.37 -9.99 59.21 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.803 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -72.44 -10.32 59.65 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.744 0.818 . . . . 0.0 111.199 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.47 -6.05 84.02 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.35 0.5 . . . . 0.0 112.523 -175.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -92.28 159.15 15.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.735 0.814 . . . . 0.0 110.333 -174.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -105.75 128.89 53.97 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 -166.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.498 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 26.5 p90 -139.2 177.83 7.62 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -123.76 171.27 9.75 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.086 0.47 . . . . 0.0 110.07 176.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.08 121.78 9.24 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 124.154 0.981 . . . . 0.0 108.434 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.537 HD23 HD13 ' A' ' 94' ' ' ILE . 1.6 tt -83.64 97.99 9.38 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -84.46 145.7 28.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.324 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -110.99 170.78 7.87 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.624 0.769 . . . . 0.0 110.839 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.29 -9.4 53.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.889 0.876 . . . . 0.0 111.673 173.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -88.01 6.26 36.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.229 1.011 . . . . 0.0 111.883 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 77.4 m80 69.92 -2.74 1.93 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 125.058 1.343 . . . . 0.0 112.34 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -99.06 150.98 21.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.432 0.693 . . . . 0.0 109.626 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.6 HG21 ' HB3' ' A' ' 96' ' ' SER . 50.4 mt -87.52 108.92 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 173.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.537 HD13 HD23 ' A' ' 86' ' ' LEU . 9.9 pt -79.32 -5.83 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.729 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . 178.67 113.91 0.39 Allowed Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 173.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 93' ' ' ILE . 52.5 p -112.33 151.22 29.98 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.917 0.858 . . . . 0.0 109.743 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.9 t -81.11 166.49 20.65 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.31 -78.02 0.15 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.15 0.58 . . . . 0.0 109.87 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.498 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 23.3 ptm -175.75 122.51 0.19 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.283 1.033 . . . . 0.0 108.943 -176.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -102.97 115.86 31.43 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.97 90.9 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.039 0.536 . . . . 0.0 110.207 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.0 p -90.23 120.05 31.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.847 0.859 . . . . 0.0 109.226 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -24.64 65.9 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.207 1.003 . . . . 0.0 113.114 -171.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -65.94 -29.39 69.8 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.239 0.616 . . . . 0.0 111.868 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.8 m -71.77 -21.22 61.76 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.871 0.868 . . . . 0.0 111.417 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.72 -40.64 88.48 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.486 0.714 . . . . 0.0 109.529 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.86 -47.38 85.3 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.359 1.063 . . . . 0.0 110.919 174.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.1 m -60.75 -36.52 79.11 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.193 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -62.44 -42.53 99.7 Favored Glycine 0 C--N 1.35 1.311 0 O-C-N 123.627 0.58 . . . . 0.0 112.881 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.46 HD13 ' HB3' ' A' ' 72' ' ' TYR . 32.5 mm -58.09 -47.1 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.197 0.599 . . . . 0.0 110.145 175.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.87 -32.3 72.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.207 1.003 . . . . 0.0 111.602 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.0 t -74.2 -41.53 61.25 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.274 0.63 . . . . 0.0 110.306 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.1 t -75.91 -26.34 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.192 0.597 . . . . 0.0 110.684 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -64.41 -39.79 94.52 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.204 0.602 . . . . 0.0 109.845 169.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.1 -47.02 21.61 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.128 0.971 . . . . 0.0 111.878 -177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -101.58 -2.72 29.85 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.674 0.79 . . . . 0.0 112.195 -170.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -75.91 -8.88 85.12 Favored Glycine 0 N--CA 1.475 1.287 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 82.7 p -80.25 -12.84 59.58 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.28 1.032 . . . . 0.0 111.567 174.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.8 m -69.97 118.23 12.55 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.904 0.882 . . . . 0.0 110.733 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -82.94 -17.71 42.65 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.409 0.683 . . . . 0.0 110.766 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.4 m -61.93 92.62 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.942 0.897 . . . . 0.0 112.425 -174.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 84.0 t -88.53 101.39 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.688 170.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -87.21 143.78 27.13 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 169.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -104.73 138.77 40.52 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.278 0.561 . . . . 0.0 110.819 -178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -129.94 -2.31 4.65 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.736 1.214 . . . . 0.0 109.912 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 37.1 p -70.32 131.47 44.19 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.6 14.73 77.52 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-O 119.647 -0.529 . . . . 0.0 112.855 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.8 t -67.78 132.48 47.51 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.9 p30 . . . . . 0 CA--C 1.558 1.268 0 C-N-CA 123.326 0.651 . . . . 0.0 111.406 -173.61 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.408 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.9 m -72.96 153.89 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.156 0.582 . . . . 0.0 110.542 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.2 pt -79.24 156.94 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 122.961 0.504 . . . . 0.0 110.817 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.7 mmt -74.9 98.8 3.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.14 96.98 4.61 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.534 0.734 . . . . 0.0 109.938 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.465 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . 163.92 168.83 26.57 Favored Glycine 0 C--N 1.342 0.864 0 O-C-N 123.682 0.614 . . . . 0.0 112.136 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.463 ' HA ' HG22 ' A' ' 121' ' ' THR . 48.2 p90 -154.76 168.84 25.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.677 0.791 . . . . 0.0 111.103 -171.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 46.1 m-85 -110.57 148.8 31.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.67 1.188 . . . . 0.0 108.438 172.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.583 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 39.3 mt-10 -133.39 111.28 10.64 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 171.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.465 HD11 ' HB3' ' A' ' 31' ' ' PHE . 26.9 tp -83.37 100.29 10.59 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.417 0.627 . . . . 0.0 109.606 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m -93.83 178.41 5.68 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.688 1.195 . . . . 0.0 110.051 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -130.37 163.13 27.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.554 0.742 . . . . 0.0 109.442 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -120.98 -169.46 1.84 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.763 0.825 . . . . 0.0 110.523 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.0 m -63.46 -30.43 71.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.96 0.904 . . . . 0.0 112.657 -170.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -89.0 12.51 15.27 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.146 0.578 . . . . 0.0 111.267 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.6 t30 63.36 20.91 12.53 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.046 1.339 . . . . 0.0 110.48 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.23 142.08 28.17 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.732 0.813 . . . . 0.0 110.169 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HB3' HD11 ' A' ' 23' ' ' LEU . 79.7 m-85 -90.96 130.71 36.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.905 1.282 . . . . 0.0 110.742 -165.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' A' ' 46' ' ' SER . 47.5 ttm-85 -134.88 127.34 30.52 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.749 1.22 . . . . 0.0 108.611 -174.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.97 135.16 33.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.5 m -113.96 131.31 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 165.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.6 OUTLIER -104.56 115.66 30.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -113.92 138.88 49.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.506 0.722 . . . . 0.0 109.684 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 174.4 11.63 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.217 0.607 . . . . 0.0 109.941 170.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.84 -14.78 68.25 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.972 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -70.8 -11.56 61.03 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.722 1.209 . . . . 0.0 111.478 174.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 88.4 0.5 82.32 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.908 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -96.42 141.73 29.37 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.699 0.799 . . . . 0.0 110.997 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.4 m -79.1 119.89 22.86 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.011 0.819 . . . . 0.0 109.335 175.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 26.2 pt -92.35 -30.53 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.271 1.028 . . . . 0.0 111.106 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.4 tp -148.55 150.59 33.62 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.808 0.843 . . . . 0.0 109.131 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.467 HG23 HH11 ' A' ' 32' ' ' ARG . 55.6 m -136.31 109.92 8.03 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.478 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 13.2 m -66.83 153.3 43.75 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.449 0.7 . . . . 0.0 109.682 173.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -82.89 -167.91 1.84 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.117 0.567 . . . . 0.0 112.195 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.18 145.21 37.8 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.464 0.706 . . . . 0.0 111.731 -173.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.489 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 96.2 m-85 -134.65 133.61 40.29 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.35 1.46 . . . . 0.0 107.732 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.4 m -61.39 -36.94 81.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.123 0.569 . . . . 0.0 110.707 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.6 m -126.31 150.68 48.34 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.333 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -67.99 -24.51 65.14 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.349 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -62.17 -36.34 81.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.45 0.7 . . . . 0.0 111.464 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.489 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.7 m -69.63 -35.38 75.18 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.229 0.612 . . . . 0.0 109.974 173.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.0 69.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.778 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -67.84 -34.82 77.45 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.25 0.62 . . . . 0.0 110.303 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -67.14 -35.88 80.67 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.099 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.21 -49.33 71.97 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 123.925 0.766 . . . . 0.0 113.337 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.5 tt -67.74 -33.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 116.961 0.38 . . . . 0.0 111.008 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.19 -37.61 87.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.845 0.458 . . . . 0.0 110.406 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.9 m -74.41 -39.5 62.61 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.029 -178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 20.2 m -67.23 -33.41 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.774 0.715 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -73.91 -35.16 64.6 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.894 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.6 t -76.25 -21.48 56.29 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.522 0.729 . . . . 0.0 110.673 176.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.571 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 0.9 OUTLIER -95.06 8.33 43.3 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.917 0.887 . . . . 0.0 110.885 176.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 39.8 t -67.49 -47.45 47.15 Favored Pre-proline 0 CA--C 1.572 1.819 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.397 171.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.93 -26.37 26.83 Favored 'Trans proline' 0 C--N 1.4 3.263 0 C-N-CA 121.957 1.771 . . . . 0.0 112.142 168.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 65' ' ' ASN . 12.0 mm100 -92.55 46.69 1.26 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.899 0.88 . . . . 0.0 109.191 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -67.44 -13.02 61.65 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -73.37 -26.04 60.84 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.786 0.834 . . . . 0.0 110.562 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.421 HH21 ' HG2' ' A' ' 73' ' ' GLU . 3.6 tpm_? -70.78 -16.29 62.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.899 0.88 . . . . 0.0 112.269 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -63.46 122.48 16.37 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 168.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HG2' HH21 ' A' ' 71' ' ' ARG . 38.0 mt-10 -94.6 110.92 22.7 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -172.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.03 104.31 1.11 Allowed 'General case' 0 C--N 1.353 0.741 0 O-C-N 123.9 0.75 . . . . 0.0 110.062 -178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -95.37 143.93 26.33 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.664 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.5 m -127.24 115.43 19.03 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.74 155.48 37.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.674 0.79 . . . . 0.0 110.573 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -68.63 -13.12 62.14 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.53 0.732 . . . . 0.0 110.685 175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -77.31 4.65 10.22 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.024 0.929 . . . . 0.0 111.713 172.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.21 17.86 77.67 Favored Glycine 0 C--N 1.351 1.413 0 C-N-CA 122.885 0.278 . . . . 0.0 113.089 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -104.7 125.8 51.15 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.831 0.852 . . . . 0.0 110.274 -176.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -79.7 137.42 37.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 172.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -150.83 176.81 10.71 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -138.21 140.82 39.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 122.048 -0.408 . . . . 0.0 110.483 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -110.74 114.34 27.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 171.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -80.73 125.29 29.87 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -109.58 138.99 45.13 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.071 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.22 161.81 13.95 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.44 0.696 . . . . 0.0 110.685 175.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.72 69.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.921 0.888 . . . . 0.0 111.323 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.41 12.26 3.81 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.555 1.142 . . . . 0.0 112.539 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 66.35 14.11 9.53 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.853 1.261 . . . . 0.0 111.677 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -88.9 128.85 35.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.494 0.718 . . . . 0.0 109.135 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.8 96.91 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.7 pt -83.46 -7.07 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.081 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -162.59 145.18 10.36 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 173.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.9 p -155.45 118.78 4.4 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.3 t -81.76 164.42 21.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 122.758 0.423 . . . . 0.0 110.615 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -75.02 -84.59 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.119 0.568 . . . . 0.0 110.085 -176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 12.7 ptp -164.55 129.73 2.74 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.975 0.91 . . . . 0.0 109.504 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.462 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 81.0 m-85 -104.25 131.76 51.22 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.649 0.78 . . . . 0.0 109.719 173.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.37 -31.37 72.02 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.958 0.903 . . . . 0.0 111.645 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 17.5 p -140.81 165.64 26.96 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.976 0.91 . . . . 0.0 110.557 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -30.7 69.53 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.399 1.08 . . . . 0.0 112.065 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -61.11 -37.44 82.8 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 123.953 0.783 . . . . 0.0 111.385 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.462 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 21.5 m -74.58 -30.78 61.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.01 0.924 . . . . 0.0 110.569 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -39.4 88.69 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.085 0.954 . . . . 0.0 110.089 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.43 -36.93 77.14 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.795 0.838 . . . . 0.0 110.71 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.0 m -62.86 -37.63 87.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.529 0.732 . . . . 0.0 109.482 172.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.412 ' O ' HG21 ' A' ' 113' ' ' VAL . . . -61.92 -48.56 82.84 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.427 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.0 mm -55.23 -50.01 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.331 0.652 . . . . 0.0 110.095 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.69 -39.35 84.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 13.7 t -76.15 -36.01 58.95 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.86 -175.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.412 HG21 ' O ' ' A' ' 109' ' ' GLY . 85.5 t -71.16 -31.9 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 118.141 0.428 . . . . 0.0 110.198 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -69.23 -43.37 74.19 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.633 0.373 . . . . 0.0 110.766 174.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.71 -48.15 56.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.565 0.746 . . . . 0.0 111.327 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.465 ' ND2' ' HA3' ' A' ' 19' ' ' GLY . 22.4 m120 -88.8 -10.54 47.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.874 0.87 . . . . 0.0 111.576 -175.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.44 -37.15 89.93 Favored Glycine 0 C--N 1.346 1.136 0 O-C-N 123.245 0.341 . . . . 0.0 112.785 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.1 t -75.78 -11.14 59.93 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.934 0.894 . . . . 0.0 112.239 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.2 m -69.5 104.56 2.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.179 0.592 . . . . 0.0 110.135 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -86.28 72.47 10.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.222 1.011 . . . . 0.0 108.802 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.463 HG22 ' HA ' ' A' ' 20' ' ' TRP . 2.1 t -145.42 93.83 2.43 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.041 -1.436 . . . . 0.0 108.898 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.2 t -109.24 123.79 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.974 0.91 . . . . 0.0 110.542 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.583 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -100.7 90.26 4.18 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 174.289 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.94 97.16 1.8 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.404 ' ND2' ' HB3' ' A' ' 22' ' ' GLU . 87.2 m-20 -84.54 -4.12 58.79 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.561 1.144 . . . . 0.0 112.445 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 47.3 p -68.53 153.28 44.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.315 0.646 . . . . 0.0 111.202 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 102.96 -19.44 46.7 Favored Glycine 0 N--CA 1.472 1.093 0 CA-C-O 119.958 -0.357 . . . . 0.0 112.442 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 34.7 p -78.5 127.12 31.71 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.159 0.583 . . . . 0.0 110.016 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.7 m120 . . . . . 0 C--O 1.251 1.158 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -177.011 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.2 m -112.33 156.57 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.05 0.94 . . . . 0.0 109.448 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.4 pt -85.1 139.99 16.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 63.1 mtt -88.78 106.2 18.21 Favored 'General case' 0 C--O 1.245 0.824 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.73 82.3 2.7 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.228 -0.896 . . . . 0.0 108.868 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.0 154.5 30.6 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.92 -172.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.2 p90 -159.05 150.13 20.12 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.799 0.839 . . . . 0.0 109.88 -178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -90.57 157.48 17.49 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.607 0.763 . . . . 0.0 109.56 172.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 123' ' ' LYS . 55.3 mt-10 -136.09 110.49 8.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.69 0.796 . . . . 0.0 109.565 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' ' 52' ' ' LYS . 29.2 tp -94.18 101.68 13.68 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.197 0.599 . . . . 0.0 109.849 -178.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.558 ' HA ' ' HB3' ' A' ' 125' ' ' ASN . 22.3 m -107.04 174.49 5.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.239 1.016 . . . . 0.0 110.702 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.39 151.65 36.59 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.199 0.999 . . . . 0.0 109.58 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.8 m -89.43 -177.65 5.39 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.771 0.829 . . . . 0.0 111.428 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.6 t -61.92 -34.82 76.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.952 0.901 . . . . 0.0 110.943 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.38 11.52 36.33 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.782 0.833 . . . . 0.0 111.078 176.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 t30 69.42 33.78 3.06 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 125.349 1.46 . . . . 0.0 112.559 174.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -81.12 139.27 35.73 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 121.748 -0.595 . . . . 0.0 110.027 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -90.16 117.47 28.95 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.393 1.077 . . . . 0.0 109.485 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -130.18 119.29 22.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.062 0.945 . . . . 0.0 109.264 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -95.24 130.54 41.94 Favored 'General case' 0 C--O 1.241 0.615 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.477 HG13 HG21 ' A' ' 45' ' ' THR . 20.7 m -106.12 170.75 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 170.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.2 125.27 42.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -112.81 138.81 49.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.97 178.49 1.78 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.454 0.702 . . . . 0.0 111.305 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -19.86 61.46 Favored Glycine 0 C--N 1.35 1.327 0 CA-C-N 116.585 -0.28 . . . . 0.0 113.031 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -67.8 -24.35 65.29 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.598 0.759 . . . . 0.0 111.779 173.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.37 15.5 58.58 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 116.537 -0.302 . . . . 0.0 113.025 -175.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -106.77 141.46 37.98 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.421 0.689 . . . . 0.0 110.317 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.9 m -67.77 122.29 17.79 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 123.602 0.564 . . . . 0.0 110.861 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.5 pt -109.85 -18.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.775 1.23 . . . . 0.0 110.651 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 tp -151.06 145.94 25.84 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.477 HG21 HG13 ' A' ' 34' ' ' VAL . 92.5 m -146.4 119.06 8.56 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.842 0.857 . . . . 0.0 108.813 178.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -82.0 177.26 8.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.919 0.487 . . . . 0.0 111.335 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -73.22 175.43 6.82 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.346 1.059 . . . . 0.0 111.725 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.0 114.65 27.25 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.414 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -99.56 147.33 25.45 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.069 0.948 . . . . 0.0 109.323 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.6 p -81.09 -31.99 34.1 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.83 0.452 . . . . 0.0 111.297 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.2 m -109.15 143.7 38.2 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.953 0.901 . . . . 0.0 109.703 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HG3' HD23 ' A' ' 23' ' ' LEU . 87.3 tttt -67.93 -37.89 82.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.978 0.511 . . . . 0.0 110.412 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.172 0.989 . . . . 0.0 111.695 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 m -64.12 -39.2 93.52 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.072 0.949 . . . . 0.0 111.25 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.97 -34.67 66.61 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.578 0.751 . . . . 0.0 110.886 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.94 -29.63 65.71 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.575 0.75 . . . . 0.0 111.1 177.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -77.96 -27.41 49.23 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.322 0.249 . . . . 0.0 111.275 170.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.85 -40.84 99.37 Favored Glycine 0 C--N 1.344 1.002 0 O-C-N 123.525 0.516 . . . . 0.0 112.827 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.4 tt -68.01 -32.82 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 120.91 0.386 . . . . 0.0 111.067 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.17 74.15 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.071 0.548 . . . . 0.0 110.677 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -70.84 -50.83 31.11 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.879 0.871 . . . . 0.0 111.344 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 59' ' ' ILE . 30.7 m -66.18 -28.84 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.293 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -53.16 -50.97 63.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.681 0.793 . . . . 0.0 110.334 -178.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -80.79 -31.99 35.54 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.826 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -96.06 -8.4 33.6 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 p -65.28 -37.02 17.24 Favored Pre-proline 0 CA--C 1.566 1.584 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -74.13 -7.9 20.37 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.768 1.645 . . . . 0.0 112.993 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.79 88.93 4.44 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 122.923 0.489 . . . . 0.0 109.768 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.439 ' HA ' ' HD1' ' A' ' 72' ' ' TYR . 12.2 pt-20 -62.02 -20.19 63.65 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.801 0.84 . . . . 0.0 111.685 176.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -54.3 -40.74 68.2 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.457 1.103 . . . . 0.0 112.044 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -83.69 -9.43 58.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.514 0.726 . . . . 0.0 112.095 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 85' ' ' ASN . 88.8 m-85 -84.01 124.65 31.28 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.454 ' HB2' ' ND2' ' A' ' 85' ' ' ASN . 41.9 mt-10 -95.5 104.11 16.0 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 173.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -73.14 101.77 3.41 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.731 0.777 . . . . 0.0 109.136 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.542 ' HE2' ' ND2' ' A' ' 85' ' ' ASN . 65.9 mttm -102.57 165.05 11.31 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.513 1.125 . . . . 0.0 109.937 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.8 m -126.3 112.2 15.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.312 0.645 . . . . 0.0 109.605 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.0 165.54 6.8 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.841 0.856 . . . . 0.0 111.02 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -64.3 -16.31 61.92 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.585 0.754 . . . . 0.0 111.98 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -81.35 -2.05 47.75 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.956 0.902 . . . . 0.0 111.986 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 77.94 14.97 81.76 Favored Glycine 0 C--N 1.349 1.27 0 C-N-CA 122.831 0.253 . . . . 0.0 112.935 -176.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.64 142.68 29.15 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.886 0.874 . . . . 0.0 109.535 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -101.23 125.48 47.86 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.865 0.466 . . . . 0.0 109.832 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.466 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 35.7 p90 -131.74 170.54 14.67 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.495 ' HB2' ' HB3' ' A' ' 97' ' ' SER . 16.6 m-85 -131.22 166.89 20.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.942 0.497 . . . . 0.0 110.142 -173.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.542 ' ND2' ' HE2' ' A' ' 75' ' ' LYS . 4.0 p30 -149.77 133.06 16.45 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 167.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.2 tp -89.78 116.24 27.73 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -96.88 140.47 31.39 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.933 -176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -98.15 166.04 11.6 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.826 0.85 . . . . 0.0 109.748 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.07 -13.84 62.32 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.088 0.555 . . . . 0.0 111.634 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.476 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 64.4 m-20 -80.1 4.1 18.34 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.816 0.847 . . . . 0.0 111.296 174.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 74.3 m80 67.25 15.46 9.99 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.02 1.328 . . . . 0.0 111.788 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.476 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 13.4 pt20 -97.67 147.02 24.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.194 0.598 . . . . 0.0 110.426 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.96 99.72 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 13.0 pt -81.22 -16.51 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.756 -177.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.83 103.26 0.2 Allowed Glycine 0 C--N 1.35 1.335 0 C-N-CA 121.701 -0.285 . . . . 0.0 113.046 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.482 ' HA ' ' HA ' ' A' ' 85' ' ' ASN . 39.8 t -92.86 113.56 25.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.661 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.495 ' HB3' ' HB2' ' A' ' 84' ' ' PHE . 46.6 t -81.8 135.85 35.43 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -75.43 172.5 12.4 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.466 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.07 118.08 16.6 Favored 'General case' 0 C--N 1.351 0.651 0 CA-C-O 121.801 0.81 . . . . 0.0 112.045 -171.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -93.95 137.09 33.55 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.485 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.16 -56.51 4.58 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.259 0.624 . . . . 0.0 110.818 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.3 p -88.26 151.68 22.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.511 0.724 . . . . 0.0 112.241 -171.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.91 -24.84 60.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.407 1.083 . . . . 0.0 111.973 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -65.81 -37.56 86.58 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.5 m -74.75 -18.59 60.47 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.249 1.02 . . . . 0.0 111.816 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -60.75 -48.95 79.46 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 173.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.7 -48.13 23.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.958 0.903 . . . . 0.0 111.043 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.8 m -61.38 -28.72 69.44 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.704 0.802 . . . . 0.0 111.265 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.427 ' O ' HG21 ' A' ' 113' ' ' VAL . . . -66.26 -51.65 42.22 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.744 178.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.7 mm -65.48 -38.07 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 122.843 0.457 . . . . 0.0 110.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -30.57 71.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.961 0.904 . . . . 0.0 111.486 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.91 -50.08 18.08 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.427 HG21 ' O ' ' A' ' 109' ' ' GLY . 66.2 t -62.17 -36.63 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 C-N-CA 122.972 0.509 . . . . 0.0 111.778 -175.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -69.95 -39.44 76.03 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 120.705 0.288 . . . . 0.0 111.337 178.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.48 -41.57 46.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.326 0.651 . . . . 0.0 111.434 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -91.08 -10.77 40.84 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.5 0.72 . . . . 0.0 110.782 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.22 -12.46 84.58 Favored Glycine 0 C--N 1.354 1.542 0 C-N-CA 122.842 0.258 . . . . 0.0 113.572 177.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.2 p -81.92 -18.31 44.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.259 0.623 . . . . 0.0 111.016 172.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.3 m -76.06 90.34 3.04 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 123.449 0.7 . . . . 0.0 110.046 -178.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -82.93 67.75 9.14 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 122.185 0.993 . . . . 0.0 109.597 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.6 t -136.65 93.3 2.85 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.0 -1.454 . . . . 0.0 109.244 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 35.4 m -85.93 141.4 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.183 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 55.5 tptt -97.07 99.3 10.81 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 174.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.85 95.24 1.91 Allowed 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.134 -175.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.558 ' HB3' ' HA ' ' A' ' 24' ' ' SER . 26.5 t-20 -79.06 -26.64 43.05 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 165.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 75.1 p -59.83 137.24 58.11 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.35 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 99.18 -19.65 53.23 Favored Glycine 0 CA--C 1.531 1.047 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.932 -174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.1 m -77.9 162.85 26.51 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.24 0.616 . . . . 0.0 111.385 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.632 -0.699 . . . . 0.0 109.575 179.19 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.379 0 N-CA-C 112.097 -0.401 . . . . 0.0 112.097 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.59 140.85 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.136 0.575 . . . . 0.0 110.138 176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.3 pt -73.11 138.35 21.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 51.8 mtt -70.08 96.12 1.03 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.65 92.92 4.84 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.536 -172.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.29 151.11 9.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.74 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -147.65 148.32 30.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.038 0.935 . . . . 0.0 109.936 -176.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -97.17 118.83 34.48 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -95.58 109.02 21.32 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.602 HD23 ' HB2' ' A' ' 52' ' ' LYS . 49.4 tp -79.72 101.47 8.43 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -103.52 139.8 38.37 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.922 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HB3' HG23 ' A' ' 126' ' ' THR . 14.8 ptmm? -95.44 130.13 42.36 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 170.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.4 m -83.98 -178.49 6.99 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 109.882 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -59.94 -25.76 65.42 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.066 0.546 . . . . 0.0 112.259 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -102.31 25.71 8.61 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.848 0.859 . . . . 0.0 111.086 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 63.88 12.18 6.58 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 125.035 1.334 . . . . 0.0 112.829 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -69.44 126.25 29.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.344 0.658 . . . . 0.0 110.941 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.48 119.95 30.37 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.195 0.998 . . . . 0.0 109.475 -170.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HB2' HD13 ' A' ' 48' ' ' LEU . 47.2 ttp85 -147.9 117.78 7.17 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.837 0.855 . . . . 0.0 108.972 -173.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -90.99 128.08 36.67 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.513 HG13 HG21 ' A' ' 45' ' ' THR . 30.5 m -107.06 130.89 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.694 0.797 . . . . 0.0 108.892 173.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.2 tp -89.77 112.93 24.37 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -105.29 129.29 53.68 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.305 1.042 . . . . 0.0 109.059 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.31 -176.98 1.99 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.937 0.495 . . . . 0.0 110.995 173.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.41 -15.06 51.39 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 115.434 0.934 . . . . 0.0 115.434 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -79.77 -14.22 58.87 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.473 0.709 . . . . 0.0 111.723 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.09 6.87 78.25 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 -165.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -84.12 117.43 23.46 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 124.465 1.106 . . . . 0.0 109.961 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.7 m -64.93 119.73 11.26 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 171.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.1 pt -104.91 -24.93 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.292 1.037 . . . . 0.0 109.993 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 13.0 tp -145.61 134.26 22.19 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -170.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.513 HG21 HG13 ' A' ' 34' ' ' VAL . 59.7 m -132.74 123.64 26.63 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.759 0.823 . . . . 0.0 108.951 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 t -83.52 -179.29 7.31 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.292 0.637 . . . . 0.0 111.408 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 93' ' ' ILE . 27.1 mm-40 -68.75 170.32 9.68 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.588 0.755 . . . . 0.0 111.643 174.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.445 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.8 mm? -89.65 113.67 25.18 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 171.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.454 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -99.1 152.15 20.17 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 124.42 1.088 . . . . 0.0 109.859 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 65.5 p -82.84 -17.58 43.44 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.515 0.726 . . . . 0.0 110.932 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.0 m -138.23 149.51 45.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.114 0.966 . . . . 0.0 110.076 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.602 ' HB2' HD23 ' A' ' 23' ' ' LEU . 3.1 pptp? -71.88 -27.17 62.67 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.194 0.598 . . . . 0.0 110.444 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 14.8 t -68.77 -27.86 66.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.989 0.516 . . . . 0.0 111.046 174.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.454 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 14.6 m -69.31 -36.42 76.99 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.034 0.534 . . . . 0.0 109.637 174.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.88 -30.94 67.45 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.167 174.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -64.39 -43.64 93.83 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.883 0.873 . . . . 0.0 110.479 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.508 ' HB3' ' HZ1' ' A' ' 57' ' ' LYS . 2.8 mmmp? -64.9 -34.05 77.49 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.981 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.63 -49.55 68.3 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.352 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.9 tt -71.4 -32.24 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 122.607 0.363 . . . . 0.0 111.076 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.95 -38.69 86.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.158 0.504 . . . . 0.0 109.796 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.6 m -71.48 -43.22 66.97 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.796 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 m -62.36 -32.65 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 118.897 0.771 . . . . 0.0 110.608 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.464 HH22 ' N ' ' A' ' 120' ' ' GLN . 14.9 ttm180 -70.39 -40.11 74.15 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.677 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -68.63 -22.28 64.43 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.101 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.462 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 60.7 m-80 -98.54 -1.94 39.91 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.441 0.696 . . . . 0.0 112.156 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.1 m -63.15 -45.76 85.85 Favored Pre-proline 0 CA--C 1.568 1.663 0 CA-C-O 118.275 -0.869 . . . . 0.0 111.657 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.8 -37.88 8.47 Favored 'Trans proline' 0 C--N 1.398 3.158 0 C-N-CA 121.762 1.641 . . . . 0.0 111.812 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG2' ' HA ' ' A' ' 65' ' ' ASN . 9.5 pt20 -98.66 58.28 1.2 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.934 1.35 . . . . 0.0 109.408 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.27 -11.71 34.29 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 113.27 -1.786 . . . . 0.0 112.899 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.19 -25.01 65.03 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.868 0.867 . . . . 0.0 111.894 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.69 -15.6 61.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.011 0.524 . . . . 0.0 112.367 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.82 127.39 31.36 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -96.92 107.33 19.82 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.506 0.722 . . . . 0.0 111.532 -168.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -73.51 112.0 9.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.034 0.534 . . . . 0.0 109.76 174.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -134.36 143.5 47.69 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 171.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.3 m -101.49 133.36 46.26 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.55 0.74 . . . . 0.0 109.71 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.4 11.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.121 0.968 . . . . 0.0 111.649 176.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 p -64.47 -25.97 68.23 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.892 0.877 . . . . 0.0 111.473 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -70.02 -23.75 63.17 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.643 0.777 . . . . 0.0 111.332 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.62 30.91 5.97 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.317 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -113.55 125.9 54.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.409 0.683 . . . . 0.0 110.921 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -83.1 128.6 34.63 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.058 0.943 . . . . 0.0 110.391 -170.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -138.37 173.58 11.46 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -131.09 135.53 47.59 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -115.51 129.51 56.56 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -91.69 99.38 12.29 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 173.362 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -106.55 135.97 47.13 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.216 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' A' ' 94' ' ' ILE . . . -100.85 170.71 8.13 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.33 1.052 . . . . 0.0 111.052 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.11 -8.95 13.72 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.509 0.723 . . . . 0.0 112.936 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.44 ' N ' HD21 ' A' ' 90' ' ' ASN . 0.7 OUTLIER -84.65 7.87 18.86 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.082 0.953 . . . . 0.0 111.311 175.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.446 ' HA ' ' HD3' ' A' ' 87' ' ' LYS . 30.7 m170 63.97 21.94 12.79 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.971 1.309 . . . . 0.0 111.687 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -116.82 129.85 56.34 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.831 0.853 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.573 HG22 ' HB3' ' A' ' 96' ' ' SER . 40.0 mt -74.05 100.73 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 122.076 0.941 . . . . 0.0 109.519 173.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.533 HD13 HD23 ' A' ' 86' ' ' LEU . 16.2 pt -75.66 -6.57 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.279 -176.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.01 99.14 0.13 Allowed Glycine 0 C--N 1.353 1.491 0 CA-C-O 120.082 -0.288 . . . . 0.0 112.528 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.573 ' HB3' HG22 ' A' ' 93' ' ' ILE . 34.3 p -92.45 116.77 29.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.4 t -69.39 164.5 22.84 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 122.975 0.51 . . . . 0.0 111.248 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -73.0 156.12 39.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.54 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 67.7 mtm -72.9 116.97 14.05 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -90.63 143.5 26.68 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 124.003 0.921 . . . . 0.0 109.17 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.04 -39.38 79.23 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.021 0.528 . . . . 0.0 110.675 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 65.3 p -117.16 150.24 39.03 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.696 0.798 . . . . 0.0 110.949 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -69.78 -25.77 63.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.052 0.941 . . . . 0.0 111.909 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.86 -29.98 68.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.686 0.394 . . . . 0.0 111.535 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -71.27 -23.99 62.07 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.123 0.569 . . . . 0.0 111.318 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.427 ' O ' HG12 ' A' ' 110' ' ' ILE . 13.1 ttt180 -61.34 -49.55 76.53 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.203 0.601 . . . . 0.0 109.754 169.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.31 -38.11 88.14 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.155 0.982 . . . . 0.0 111.223 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 48.4 m -66.32 -37.28 85.02 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.178 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.33 -35.84 88.37 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.903 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 106' ' ' ARG . 43.6 mm -59.83 -46.67 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.02 -35.66 81.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.831 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.6 t -71.1 -42.93 68.65 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.708 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.92 -27.08 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.506 0.723 . . . . 0.0 111.058 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -66.04 -47.42 74.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.011 0.925 . . . . 0.0 108.997 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.39 -47.69 22.39 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.647 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.425 ' HB3' HD13 ' A' ' 35' ' ' LEU . 77.9 m-20 -83.66 -14.37 51.98 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.51 0.724 . . . . 0.0 111.952 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -70.62 -30.57 68.53 Favored Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.104 -0.399 . . . . 0.0 112.104 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -91.17 9.18 32.18 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.025 0.93 . . . . 0.0 111.343 175.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -103.51 108.68 20.04 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.182 0.993 . . . . 0.0 108.852 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.464 ' N ' HH22 ' A' ' 63' ' ' ARG . 48.5 tt0 -92.82 38.66 1.03 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.276 0.63 . . . . 0.0 111.108 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.3 m -79.26 75.72 5.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 t -91.04 97.5 7.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -77.54 125.55 29.52 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.652 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -77.47 95.17 4.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 172.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.32 -0.75 57.23 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 121.595 0.712 . . . . 0.0 109.44 174.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 25' ' ' LYS . 25.9 p -72.53 116.81 13.44 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 169.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 87.9 25.68 31.37 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-N 116.606 -0.27 . . . . 0.0 113.023 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.1 m -78.49 82.24 4.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.606 0.762 . . . . 0.0 109.186 174.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 CA--C 1.558 1.274 0 C-N-CA 123.118 0.567 . . . . 0.0 111.139 -177.107 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.337 0 N-CA-C 112.002 -0.439 . . . . 0.0 112.002 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -81.25 157.26 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.443 0.697 . . . . 0.0 110.429 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.6 pt -81.58 161.04 3.78 Favored 'Isoleucine or valine' 0 C--O 1.248 1.017 0 C-N-CA 123.182 0.593 . . . . 0.0 110.334 175.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -73.3 110.12 7.35 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 173.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.17 83.59 0.73 Allowed 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.175 0.59 . . . . 0.0 110.047 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 174.03 149.22 6.91 Favored Glycine 0 C--N 1.34 0.754 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.802 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -145.16 150.06 36.08 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.413 1.085 . . . . 0.0 110.186 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -95.34 153.03 17.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.843 0.857 . . . . 0.0 109.46 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -133.32 109.77 9.6 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.5 tp -82.01 102.0 10.69 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -101.11 -177.63 3.51 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.432 1.093 . . . . 0.0 109.507 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.506 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 18.7 ptpt -138.71 165.9 25.77 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.041 0.536 . . . . 0.0 109.757 169.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.3 t -100.55 -174.07 2.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.861 0.864 . . . . 0.0 108.878 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 t -62.28 -35.28 78.53 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.458 0.703 . . . . 0.0 111.525 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -90.79 26.37 2.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.154 0.582 . . . . 0.0 111.532 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.506 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.2 m-20 62.99 19.22 11.5 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.536 1.134 . . . . 0.0 112.263 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -71.52 116.5 11.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.671 0.788 . . . . 0.0 109.731 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.5 120.61 28.02 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.001 0.521 . . . . 0.0 110.06 -168.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 ttt85 -142.51 116.25 9.23 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.028 1.331 . . . . 0.0 108.116 -170.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -102.91 145.83 29.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.241 0.544 . . . . 0.0 110.597 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.521 HG13 HG23 ' A' ' 45' ' ' THR . 29.5 m -106.86 171.4 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 108.789 175.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 24.3 tp -137.54 109.56 7.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 173.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.529 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 65.5 mttm -95.14 141.93 28.18 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 178.05 7.01 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 168.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.52 -18.22 63.21 Favored Glycine 0 N--CA 1.48 1.596 0 C-N-CA 122.898 0.285 . . . . 0.0 113.035 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -63.73 -21.57 66.47 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 125.156 1.382 . . . . 0.0 111.89 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.82 2.22 75.66 Favored Glycine 0 C--N 1.35 1.354 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -173.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -98.35 130.43 45.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.918 1.287 . . . . 0.0 109.818 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 30.4 m -72.34 121.47 19.53 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.391 0.615 . . . . 0.0 110.532 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -99.99 -24.37 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.92 1.288 . . . . 0.0 111.5 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -146.1 143.62 29.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.521 HG23 HG13 ' A' ' 34' ' ' VAL . 48.2 m -146.15 114.48 6.68 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.308 0.643 . . . . 0.0 109.71 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 m -69.39 164.29 23.3 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.931 0.892 . . . . 0.0 111.347 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -83.39 178.19 8.15 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.394 0.616 . . . . 0.0 111.948 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.57 113.36 11.74 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.222 -177.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.4 ' HH ' ' HA ' ' A' ' 94' ' ' ILE . 96.9 m-85 -95.76 156.78 16.18 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.006 0.922 . . . . 0.0 109.002 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.7 m -82.31 -24.47 34.61 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 173.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.7 t -126.61 146.87 50.0 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.365 0.666 . . . . 0.0 111.316 -174.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -75.08 -27.84 60.09 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.207 176.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.7 m -63.49 -38.42 91.07 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.54 1.536 . . . . 0.0 110.925 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.3 m -65.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.551 0.74 . . . . 0.0 110.606 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.31 -30.81 57.87 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.158 0.983 . . . . 0.0 111.92 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -73.98 -38.08 64.26 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.516 0.726 . . . . 0.0 110.143 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.537 ' HZ1' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -76.86 -22.79 52.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.248 169.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.97 93.36 Favored Glycine 0 C--N 1.349 1.281 0 O-C-N 123.745 0.653 . . . . 0.0 112.655 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.518 ' HA ' HG21 ' A' ' 62' ' ' VAL . 5.7 tt -65.55 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 122.341 0.256 . . . . 0.0 110.37 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -35.76 81.56 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.074 0.55 . . . . 0.0 110.893 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.9 m -73.7 -43.84 58.17 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.57 0.748 . . . . 0.0 111.621 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' A' ' 59' ' ' ILE . 18.8 m -70.11 -29.11 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.533 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -67.89 -45.14 75.33 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.919 0.888 . . . . 0.0 108.887 176.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 42.6 t -64.97 -15.79 62.63 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.076 0.95 . . . . 0.0 111.892 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.99 18.47 9.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.443 0.697 . . . . 0.0 112.392 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -63.19 -45.85 85.67 Favored Pre-proline 0 CA--C 1.567 1.619 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.195 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.64 -12.81 11.03 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 121.614 1.543 . . . . 0.0 113.093 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -75.98 84.66 2.88 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.484 0.659 . . . . 0.0 110.868 -173.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.06 -28.7 70.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.147 1.379 . . . . 0.0 112.045 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -63.24 -35.82 81.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.659 0.783 . . . . 0.0 110.824 174.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.43 ' HA ' ' NE ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.19 -19.99 35.48 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.453 -174.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -70.83 106.3 3.55 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 167.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -97.63 107.4 19.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.434 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.99 123.69 43.45 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.118 0.967 . . . . 0.0 109.75 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -132.99 150.65 52.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.844 1.257 . . . . 0.0 109.633 -175.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.2 m -92.79 117.26 29.82 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.581 0.752 . . . . 0.0 109.518 171.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.86 163.53 7.46 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.078 0.951 . . . . 0.0 112.235 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -68.58 -14.68 63.18 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.269 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -82.79 1.87 36.85 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.086 0.955 . . . . 0.0 111.772 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.81 32.91 58.52 Favored Glycine 0 C--N 1.353 1.506 0 C-N-CA 123.121 0.391 . . . . 0.0 112.951 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.526 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 74.8 mmtt -122.94 150.28 43.16 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.114 0.965 . . . . 0.0 109.728 -177.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -96.57 126.82 42.02 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.307 0.643 . . . . 0.0 109.987 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -137.79 176.69 8.48 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -141.46 166.14 25.56 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.907 0.483 . . . . 0.0 110.116 173.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -148.51 135.57 20.12 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.663 HD12 HD13 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -88.51 119.41 28.93 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -93.16 139.28 30.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.318 1.047 . . . . 0.0 109.896 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.2 176.1 7.09 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.279 0.632 . . . . 0.0 110.643 177.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.63 -23.71 65.38 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 121.448 0.642 . . . . 0.0 110.126 169.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -79.56 -3.81 48.6 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.728 174.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.6 m80 65.42 15.57 10.09 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 125.737 1.615 . . . . 0.0 111.235 -175.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -88.23 154.7 20.22 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 123.703 0.801 . . . . 0.0 110.048 177.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.475 HG23 ' HB2' ' A' ' 96' ' ' SER . 13.9 mm -84.14 99.16 6.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.663 HD13 HD12 ' A' ' 86' ' ' LEU . 10.0 pt -83.6 -8.38 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 122.801 0.44 . . . . 0.0 111.82 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.76 103.85 0.19 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.802 -0.443 . . . . 0.0 112.293 176.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.475 ' HB2' HG23 ' A' ' 93' ' ' ILE . 34.6 t -100.57 119.39 38.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.805 0.842 . . . . 0.0 109.229 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.3 t -73.77 167.33 21.63 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.94 0.496 . . . . 0.0 110.8 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.44 ' NE2' ' HB ' ' A' ' 42' ' ' THR . 77.5 mt-30 -85.38 166.63 16.26 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.382 0.673 . . . . 0.0 110.494 177.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 72.1 mtm -74.35 118.63 17.54 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.579 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -94.41 144.3 25.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.124 0.97 . . . . 0.0 109.005 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.526 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -62.25 -58.02 9.28 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.418 0.687 . . . . 0.0 110.707 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.7 p -110.73 169.15 8.95 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.022 0.929 . . . . 0.0 110.954 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.74 -30.01 65.15 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.97 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -64.41 -32.49 74.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.109 0.564 . . . . 0.0 110.971 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.4 t -79.05 -32.89 45.02 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.755 0.822 . . . . 0.0 110.426 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -69.22 -38.72 78.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.724 0.81 . . . . 0.0 111.515 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -75.61 -29.87 59.38 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 122.95 0.5 . . . . 0.0 111.281 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 47.0 m -65.83 -34.31 77.86 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.43 -46.22 93.11 Favored Glycine 0 C--N 1.351 1.372 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.153 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.0 mm -55.09 -46.84 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.54 0.736 . . . . 0.0 109.839 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.22 93.16 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.9 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.7 t -71.63 -46.57 58.66 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.205 0.602 . . . . 0.0 110.361 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 81.0 t -64.86 -30.9 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.943 0.897 . . . . 0.0 111.124 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.92 -51.5 54.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.362 0.665 . . . . 0.0 110.405 173.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.84 -20.94 55.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.802 0.841 . . . . 0.0 112.431 -172.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -112.17 -8.16 14.01 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.824 0.849 . . . . 0.0 111.051 -178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.74 -28.13 65.72 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 172.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.533 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 12.6 t -74.25 -9.36 58.53 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.0 0.92 . . . . 0.0 111.83 175.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.4 t -72.92 147.01 45.71 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.206 0.602 . . . . 0.0 109.437 176.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -131.46 25.21 4.8 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.589 0.756 . . . . 0.0 110.657 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.4 t -95.88 110.84 22.96 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 172.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.3 t -119.27 117.32 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 110.209 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -78.27 135.74 37.61 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.124 . . . . 0.0 109.182 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -89.02 107.99 19.34 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -114.76 15.39 17.52 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.657 0.783 . . . . 0.0 110.305 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.6 p -64.15 89.05 0.06 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.431 0.692 . . . . 0.0 111.745 -175.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . 0.416 ' N ' ' HG2' ' A' ' 25' ' ' LYS . . . 66.27 44.37 90.93 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.816 175.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 17.8 t -68.8 90.81 0.43 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.683 0.793 . . . . 0.0 109.744 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.2 t30 . . . . . 0 C--O 1.251 1.145 0 C-N-CA 124.216 1.006 . . . . 0.0 109.585 -172.0 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m -89.14 152.55 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.511 0.725 . . . . 0.0 110.11 174.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 pp -83.14 161.87 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 122.763 0.425 . . . . 0.0 110.463 174.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.5 mmt -128.61 130.63 47.58 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.33 74.89 9.27 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.268 0.627 . . . . 0.0 110.602 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.6 157.04 7.49 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.391 -0.822 . . . . 0.0 113.751 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -165.39 155.52 13.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.296 1.038 . . . . 0.0 109.842 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' A' ' 35' ' ' LEU . 59.6 m-85 -97.4 148.41 23.21 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.575 0.75 . . . . 0.0 109.937 169.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.545 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -129.75 117.61 20.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.852 0.861 . . . . 0.0 108.703 170.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 31' ' ' PHE . 28.7 tp -81.63 102.45 10.68 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 175.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.1 m -106.49 162.84 13.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.217 1.007 . . . . 0.0 108.816 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -121.44 165.68 15.23 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 61.0 p -96.75 173.79 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 123.932 0.893 . . . . 0.0 110.034 176.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.1 t -67.46 -21.72 65.53 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.351 0.596 . . . . 0.0 110.244 171.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.78 -13.14 60.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.321 1.048 . . . . 0.0 111.657 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 86.0 -7.04 0.8 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 126.348 1.859 . . . . 0.0 112.4 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.636 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 8.7 mp0 -65.63 132.96 50.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.196 0.598 . . . . 0.0 110.675 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.517 ' HB3' HD11 ' A' ' 23' ' ' LEU . 83.7 m-85 -91.31 148.54 22.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.358 1.063 . . . . 0.0 110.58 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -152.59 129.9 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.433 0.693 . . . . 0.0 109.306 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -91.21 126.93 36.45 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 173.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.38 130.27 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -99.25 123.01 43.2 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 173.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -118.68 149.51 41.29 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.259 1.024 . . . . 0.0 108.901 177.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.84 -179.15 6.4 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.441 0.696 . . . . 0.0 110.242 172.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.44 -20.27 65.41 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-O 120.997 0.221 . . . . 0.0 112.99 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -78.43 -10.3 59.64 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.293 1.037 . . . . 0.0 111.186 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.81 -0.66 89.15 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 123.035 0.35 . . . . 0.0 113.067 -175.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.38 121.76 20.06 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.064 0.945 . . . . 0.0 110.132 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 m -71.39 120.2 16.63 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.421 HD11 ' HG ' ' A' ' 35' ' ' LEU . 26.7 pt -109.98 -8.35 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.699 1.2 . . . . 0.0 111.159 -177.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 16.9 tp -164.31 151.25 11.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.153 0.581 . . . . 0.0 110.487 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 46.7 m -146.1 126.34 13.89 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.466 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 87.3 p -67.01 155.13 39.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.35 0.66 . . . . 0.0 111.031 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.86 138.39 58.14 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.636 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 10.4 mp -64.07 111.97 2.77 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.199 0.523 . . . . 0.0 110.582 -173.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.42 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.3 m-85 -82.34 147.6 28.76 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.247 1.019 . . . . 0.0 110.657 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 m -69.76 -37.24 76.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.562 0.745 . . . . 0.0 110.886 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -112.69 155.33 24.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.564 0.746 . . . . 0.0 110.848 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -62.91 -43.18 99.48 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.946 0.898 . . . . 0.0 109.14 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.5 p -61.02 -40.78 94.85 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.086 0.866 . . . . 0.0 110.917 -177.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.42 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 20.0 m -63.13 -39.97 96.23 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.613 0.765 . . . . 0.0 110.931 178.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.2 84.32 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.527 0.731 . . . . 0.0 110.992 176.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -68.66 -32.11 71.71 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.667 0.787 . . . . 0.0 111.082 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -77.82 -22.94 49.25 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.086 0.554 . . . . 0.0 110.949 171.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.57 94.83 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.819 0.699 . . . . 0.0 113.778 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.419 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.5 tt -64.16 -37.79 80.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 117.02 0.41 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.96 71.27 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.289 0.635 . . . . 0.0 110.952 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 m -73.14 -49.96 25.32 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.624 177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.419 HG21 ' HA ' ' A' ' 59' ' ' ILE . 26.0 m -65.46 -38.8 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.538 -173.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -65.56 -32.99 74.88 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.074 0.464 . . . . 0.0 110.923 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 t -74.27 -24.53 59.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.594 0.758 . . . . 0.0 111.03 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -107.41 3.1 24.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.312 0.645 . . . . 0.0 111.469 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.483 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 75.7 m -63.76 -43.6 77.22 Favored Pre-proline 0 N--CA 1.487 1.393 0 CA-C-O 118.545 -0.741 . . . . 0.0 112.768 174.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -83.95 18.93 1.44 Allowed 'Trans proline' 0 C--N 1.38 2.222 0 CA-C-N 121.657 1.628 . . . . 0.0 113.02 175.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -118.79 96.63 5.34 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.09 0.956 . . . . 0.0 109.895 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -26.7 68.4 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.917 0.487 . . . . 0.0 110.199 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -45.88 -40.8 10.49 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.815 1.646 . . . . 0.0 112.513 171.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -90.06 -23.82 21.33 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.338 0.655 . . . . 0.0 111.253 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -70.41 118.41 13.19 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 120.649 0.262 . . . . 0.0 110.333 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -96.04 98.64 10.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -66.45 103.61 1.08 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -124.87 139.77 53.53 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.642 0.777 . . . . 0.0 109.731 -164.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -97.28 127.93 43.68 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.228 0.611 . . . . 0.0 110.083 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.28 150.67 40.1 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.887 0.875 . . . . 0.0 110.71 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 t -71.4 -8.17 52.08 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 121.313 0.578 . . . . 0.0 110.016 171.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.529 HD21 ' HG2' ' A' ' 99' ' ' MET . 62.0 m-20 -74.57 -3.74 32.84 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.557 1.143 . . . . 0.0 111.906 169.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.94 13.51 82.08 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 123.042 0.353 . . . . 0.0 112.625 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -110.64 178.42 4.37 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.208 1.003 . . . . 0.0 110.202 -177.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -126.3 127.77 46.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.69 0.396 . . . . 0.0 110.982 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.622 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 20.3 p90 -129.65 176.7 7.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.835 1.254 . . . . 0.0 108.688 174.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -133.54 150.35 51.67 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.768 0.318 . . . . 0.0 110.174 174.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.506 ' ND2' ' HE3' ' A' ' 87' ' ' LYS . 3.4 p-10 -133.41 124.08 26.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.52 129.23 34.88 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 123.816 0.847 . . . . 0.0 109.614 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.506 ' HE3' ' ND2' ' A' ' 85' ' ' ASN . 34.2 mmtp -99.82 162.01 13.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.298 1.039 . . . . 0.0 111.355 -178.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.43 179.52 4.25 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.183 -1.372 . . . . 0.0 109.413 173.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.36 -15.63 63.35 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.06 0.544 . . . . 0.0 111.128 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -96.9 16.49 19.2 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.661 0.784 . . . . 0.0 111.968 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 80.6 m80 64.24 9.5 4.86 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 124.433 1.093 . . . . 0.0 112.723 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -88.04 146.47 25.45 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.248 0.619 . . . . 0.0 110.508 -176.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.4 mt -82.88 100.57 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.9 pt -86.98 -13.1 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.829 177.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.466 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -153.11 149.83 21.47 Favored Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 176.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 p -158.32 128.54 6.07 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.479 0.711 . . . . 0.0 109.502 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.7 t -107.37 166.97 10.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.688 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -75.03 161.24 29.62 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.508 0.723 . . . . 0.0 110.724 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.622 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -74.7 118.67 17.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.381 0.61 . . . . 0.0 110.005 -178.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.51 148.44 27.21 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.316 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.33 71.79 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.956 0.902 . . . . 0.0 112.117 -177.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.3 p -128.94 162.68 27.0 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.483 0.713 . . . . 0.0 110.188 175.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -65.5 -36.09 82.81 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.139 172.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.0 -37.91 89.06 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.489 0.715 . . . . 0.0 111.503 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.0 t -67.92 -30.58 69.94 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.57 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -70.59 -38.21 74.0 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.865 0.466 . . . . 0.0 110.704 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 7.1 mm-40 -68.09 -28.9 67.74 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.127 0.571 . . . . 0.0 111.011 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.2 m -61.72 -45.95 91.75 Favored 'General case' 0 C--N 1.349 0.577 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.07 -34.84 91.01 Favored Glycine 0 C--N 1.349 1.285 0 CA-C-N 115.056 -0.974 . . . . 0.0 113.526 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 28.6 mm -60.05 -52.37 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.1 66.44 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.473 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.1 t -70.72 -50.07 40.2 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.248 0.619 . . . . 0.0 110.003 -178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.55 -30.67 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 C-N-CA 123.504 0.721 . . . . 0.0 110.871 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 83.9 tttt -64.2 -35.02 79.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.432 0.693 . . . . 0.0 111.45 177.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -93.49 -36.17 12.58 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.663 0.785 . . . . 0.0 112.49 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -103.76 -8.56 19.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.096 0.958 . . . . 0.0 111.785 -168.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.61 -22.79 73.61 Favored Glycine 0 N--CA 1.472 1.041 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.131 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -84.06 -12.12 55.63 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.662 0.785 . . . . 0.0 111.354 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.8 m -69.42 101.59 1.59 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 109.888 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -82.86 18.95 1.45 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.272 0.629 . . . . 0.0 111.915 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.6 m -75.32 93.95 2.96 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.298 1.039 . . . . 0.0 109.353 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.62 139.32 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.662 0.785 . . . . 0.0 110.903 -172.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.545 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -118.91 115.36 24.21 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.351 1.06 . . . . 0.0 109.099 175.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.38 97.35 7.68 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 121.421 0.629 . . . . 0.0 111.142 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.59 -16.01 58.87 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.179 0.992 . . . . 0.0 111.312 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 35.9 p -61.58 114.88 3.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.553 1.141 . . . . 0.0 112.459 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 82.66 56.73 2.72 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.707 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.4 t -133.64 164.28 27.55 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.643 0.777 . . . . 0.0 109.753 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 N--CA 1.487 1.407 0 C-N-CA 123.517 0.727 . . . . 0.0 112.045 -174.675 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.196 0 CA-C-O 119.928 -0.373 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 36.0 m -89.95 159.61 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.028 0.931 . . . . 0.0 109.952 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.3 pt -72.06 149.16 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 120.885 0.374 . . . . 0.0 110.117 174.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -103.76 104.17 14.15 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.093 0.557 . . . . 0.0 109.589 -178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.58 131.45 40.31 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.14 173.78 50.47 Favored Glycine 0 C--N 1.333 0.415 0 O-C-N 123.375 0.422 . . . . 0.0 113.526 -179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 38.3 p90 -119.51 160.3 22.66 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.916 0.887 . . . . 0.0 110.597 -173.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -86.95 153.31 21.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.976 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.436 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 86.6 mt-10 -132.86 121.21 22.57 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 167.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.28 98.16 5.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -99.33 163.04 12.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.84 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 17.2 ptpt -133.83 134.12 42.42 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 168.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.9 m -76.62 175.47 9.27 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.319 0.581 . . . . 0.0 110.896 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 t -67.5 -12.58 60.65 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.619 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -83.37 3.59 31.08 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.658 1.183 . . . . 0.0 112.219 175.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 m120 65.67 15.32 9.99 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.167 0.987 . . . . 0.0 111.923 -175.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -96.29 137.76 34.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.864 0.865 . . . . 0.0 109.914 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -90.55 144.22 25.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.034 0.534 . . . . 0.0 110.73 -175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -156.97 147.04 20.96 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 109.064 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -94.28 127.5 40.18 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.3 m -107.47 132.8 54.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 116' ' ' ASN . 11.5 mt -99.24 112.24 24.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.395 0.678 . . . . 0.0 109.257 177.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -102.75 125.94 49.68 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.98 178.05 1.2 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 123.758 0.661 . . . . 0.0 111.097 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.91 -12.75 37.34 Favored Glycine 0 CA--C 1.541 1.685 0 N-CA-C 114.079 0.392 . . . . 0.0 114.079 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -85.2 -6.22 59.29 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.411 1.085 . . . . 0.0 112.017 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 14.32 81.9 Favored Glycine 0 N--CA 1.473 1.121 0 C-N-CA 122.727 0.204 . . . . 0.0 112.982 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -102.75 121.5 42.59 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.328 1.051 . . . . 0.0 109.764 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.1 m -66.21 120.97 14.17 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.074 0.55 . . . . 0.0 110.459 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.2 pt -99.93 -35.41 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 124.616 1.166 . . . . 0.0 110.366 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 20.4 tp -137.38 148.47 46.25 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.701 0.801 . . . . 0.0 109.926 -169.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.1 m -145.15 116.81 8.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.32 0.648 . . . . 0.0 109.506 175.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.5 t -65.44 157.72 28.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.087 0.955 . . . . 0.0 110.801 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.84 164.83 18.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.126 0.571 . . . . 0.0 111.153 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.65 127.92 34.33 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.167 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -107.7 142.68 37.32 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.119 0.968 . . . . 0.0 109.706 177.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.3 -22.5 63.79 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.368 0.667 . . . . 0.0 111.749 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.7 t -148.42 159.5 43.97 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.237 0.615 . . . . 0.0 111.483 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -27.96 68.3 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.786 0.835 . . . . 0.0 111.177 176.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.9 t -71.27 -32.51 68.79 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.912 0.485 . . . . 0.0 110.731 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 16.4 m -69.04 -40.87 78.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.492 0.717 . . . . 0.0 109.61 173.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.98 -31.67 72.39 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.355 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.83 -40.33 95.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.546 0.739 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -71.3 -34.37 70.55 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.525 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.45 98.29 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.637 -0.711 . . . . 0.0 113.14 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.498 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.6 tt -74.68 -37.73 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.741 0.27 . . . . 0.0 110.742 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.62 70.47 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.059 0.544 . . . . 0.0 110.267 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 m -71.53 -55.71 7.29 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.708 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.498 HG22 ' HA ' ' A' ' 59' ' ' ILE . 33.7 m -59.61 -31.2 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-N 118.27 0.486 . . . . 0.0 111.758 -176.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -62.5 -47.85 82.12 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.54 1.136 . . . . 0.0 110.546 176.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.3 m -72.26 -26.1 61.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.025 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.484 ' ND2' ' HG2' ' A' ' 71' ' ' ARG . 4.3 m-20 -96.39 1.59 51.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.326 1.051 . . . . 0.0 111.794 -174.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.539 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 23.5 m -59.46 -50.27 88.08 Favored Pre-proline 0 CA--C 1.565 1.525 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.777 175.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -83.03 -5.78 11.29 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.824 1.682 . . . . 0.0 113.232 175.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -83.32 78.35 9.64 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.62 -30.22 71.36 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.925 0.89 . . . . 0.0 112.055 -175.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.18 -24.45 59.37 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.626 0.77 . . . . 0.0 111.195 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.484 ' HG2' ' ND2' ' A' ' 65' ' ' ASN . 3.4 tpm_? -75.79 -23.25 55.87 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.196 0.599 . . . . 0.0 110.661 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -70.55 120.56 16.36 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -101.36 108.3 19.88 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.482 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 135.58 33.49 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.665 0.386 . . . . 0.0 110.093 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -155.59 161.43 40.84 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 109.747 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.9 m -92.56 141.55 28.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.05 0.54 . . . . 0.0 109.814 176.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.69 158.0 28.45 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.712 0.805 . . . . 0.0 109.943 170.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.9 t -64.06 -23.79 67.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.307 0.643 . . . . 0.0 110.714 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -66.9 -18.44 65.38 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.876 0.871 . . . . 0.0 111.693 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.88 -7.9 42.12 Favored Glycine 0 C--N 1.349 1.271 0 C-N-CA 122.961 0.315 . . . . 0.0 113.591 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.524 ' HG3' ' HA ' ' A' ' 101' ' ' ALA . 0.0 OUTLIER -99.31 146.18 26.52 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.18 0.592 . . . . 0.0 110.734 -176.367 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -90.43 139.19 30.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.155 0.982 . . . . 0.0 110.415 -172.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -148.64 174.86 11.71 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.674 0.79 . . . . 0.0 109.268 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -131.14 138.74 49.6 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.458 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.515 HD21 HD11 ' A' ' 93' ' ' ILE . 11.5 m-20 -114.9 105.56 13.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.892 1.277 . . . . 0.0 108.904 172.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.505 HD23 HD13 ' A' ' 94' ' ' ILE . 0.7 OUTLIER -78.7 111.6 14.96 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 173.216 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -120.73 146.18 46.74 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 176.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.418 ' HB1' HD11 ' A' ' 94' ' ' ILE . . . -86.44 -173.88 4.74 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.443 0.697 . . . . 0.0 111.13 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.35 -28.1 67.91 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -95.9 24.42 5.49 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.096 0.558 . . . . 0.0 111.571 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.0 t60 72.3 -3.79 2.19 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -70.61 112.63 7.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.381 0.672 . . . . 0.0 109.93 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.515 HD11 HD21 ' A' ' 85' ' ' ASN . 57.0 mt -67.39 98.35 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 122.032 0.92 . . . . 0.0 109.071 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.505 HD13 HD23 ' A' ' 86' ' ' LEU . 21.3 pt -82.67 -6.68 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.144 -178.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -164.03 117.24 0.75 Allowed Glycine 0 C--N 1.345 1.034 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.5 t -116.12 114.86 25.07 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.903 0.881 . . . . 0.0 108.944 175.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.9 p -81.79 167.76 18.72 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.842 0.457 . . . . 0.0 111.283 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -77.23 164.31 25.72 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.226 177.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.8 ptp -73.58 123.5 24.1 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -102.31 122.08 43.54 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.77 0.828 . . . . 0.0 109.773 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.524 ' HA ' ' HG3' ' A' ' 81' ' ' LYS . . . -62.79 -40.72 98.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.816 0.846 . . . . 0.0 110.845 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.469 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 39.1 p -104.87 131.3 52.53 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.21 65.35 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.306 1.042 . . . . 0.0 111.828 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.469 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 10.8 pt20 -62.93 -37.43 87.0 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.024 0.53 . . . . 0.0 110.737 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 13.9 t -71.31 -28.53 64.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.383 0.673 . . . . 0.0 110.515 -177.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -67.36 -51.2 55.1 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.105 0.962 . . . . 0.0 109.87 177.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.96 -29.09 60.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.095 0.558 . . . . 0.0 111.948 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 98.0 m -67.57 -33.51 75.17 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.2 -30.12 76.56 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.171 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.3 mm -64.96 -49.39 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-O 121.368 0.604 . . . . 0.0 109.886 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.91 73.08 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.198 178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.2 t -71.13 -48.65 50.89 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.16 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.19 -27.12 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.448 0.699 . . . . 0.0 110.724 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.539 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 38.8 ttpt -66.59 -46.75 74.92 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 172.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.58 -33.66 69.24 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.906 0.883 . . . . 0.0 111.92 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.609 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -84.39 -30.99 24.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 0.0 110.01 -177.158 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.54 -41.17 58.27 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.5 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.1 p -80.47 -4.71 54.84 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.446 0.698 . . . . 0.0 111.713 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.8 t -75.77 -34.33 60.24 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.992 0.517 . . . . 0.0 109.835 173.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 67.75 -7.64 0.58 Allowed 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 125.37 1.468 . . . . 0.0 114.261 167.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 t -80.31 123.98 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.229 0.612 . . . . 0.0 110.768 -170.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 57.6 t -105.52 133.95 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 123.35 0.66 . . . . 0.0 111.303 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.436 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 43.1 tptt -110.45 141.76 43.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.11 1.364 . . . . 0.0 108.411 173.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -84.24 112.4 20.25 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -110.7 11.59 22.67 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.891 0.853 . . . . 0.0 109.687 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.447 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 21.7 p -70.51 156.75 38.97 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.255 1.022 . . . . 0.0 110.82 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 102.59 -42.18 1.96 Allowed Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -172.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 39.3 t -70.79 104.33 2.86 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.653 0.781 . . . . 0.0 109.097 173.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 123.797 0.839 . . . . 0.0 109.918 -176.772 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.907 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.5 m -85.04 155.86 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.362 0.665 . . . . 0.0 110.072 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.8 pt -74.3 156.15 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-O 121.013 0.435 . . . . 0.0 110.98 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.8 ptp -132.31 -179.66 5.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.141 0.976 . . . . 0.0 108.843 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.52 118.88 30.41 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 122.997 0.519 . . . . 0.0 110.447 -178.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . 88.8 143.05 9.04 Favored Glycine 0 C--N 1.348 1.229 0 O-C-N 123.499 0.5 . . . . 0.0 114.011 172.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -152.2 169.87 21.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.844 0.858 . . . . 0.0 109.958 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -109.98 127.15 54.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.347 1.059 . . . . 0.0 109.568 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -91.97 106.87 18.8 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 167.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 64.6 tp -85.52 98.5 10.66 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -113.37 177.92 4.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.937 0.895 . . . . 0.0 109.735 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -141.75 156.0 45.61 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.626 0.77 . . . . 0.0 109.935 175.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.6 m -89.86 178.69 6.17 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.126 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -66.65 -22.85 66.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.616 0.766 . . . . 0.0 110.801 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -91.11 15.36 11.86 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.415 0.686 . . . . 0.0 111.285 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 67.3 14.96 9.87 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.243 1.417 . . . . 0.0 112.75 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 16.0 mm100 -70.32 124.86 25.2 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.67 0.788 . . . . 0.0 110.997 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.84 118.68 24.64 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.809 0.844 . . . . 0.0 108.942 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -142.49 118.99 10.95 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.92 0.888 . . . . 0.0 109.093 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -94.04 132.03 38.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.571 HG12 HG22 ' A' ' 45' ' ' THR . 23.2 m -107.45 133.97 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 171.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.9 tp -90.0 120.79 31.51 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -106.8 153.95 21.72 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.692 1.197 . . . . 0.0 109.653 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.19 177.66 8.88 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.775 168.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.34 -23.53 62.43 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.449 173.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -67.35 -18.89 65.33 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.766 1.227 . . . . 0.0 111.769 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.89 -7.82 80.66 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.796 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.05 136.23 36.53 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.286 0.634 . . . . 0.0 109.712 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.0 m -73.15 120.84 19.33 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.342 0.591 . . . . 0.0 109.779 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.541 HD11 ' HG ' ' A' ' 35' ' ' LEU . 22.0 pt -103.74 -16.52 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.606 1.162 . . . . 0.0 111.245 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.7 tp -157.8 141.7 15.79 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -176.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.571 HG22 HG12 ' A' ' 34' ' ' VAL . 53.3 m -133.16 113.45 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.242 0.617 . . . . 0.0 109.652 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -69.5 164.82 22.3 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.964 0.506 . . . . 0.0 110.799 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -75.92 166.01 24.14 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.399 0.619 . . . . 0.0 111.601 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.86 114.18 15.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.642 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -100.37 145.57 28.02 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.587 0.755 . . . . 0.0 109.17 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -90.15 -2.13 58.03 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 120.988 0.423 . . . . 0.0 111.099 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.409 ' HB3' HG22 ' A' ' 53' ' ' THR . 50.8 m -142.03 137.25 30.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.507 0.723 . . . . 0.0 110.549 -177.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -28.24 69.78 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.939 0.895 . . . . 0.0 111.64 178.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.409 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -63.22 -33.72 76.11 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.459 0.704 . . . . 0.0 111.156 178.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 m -76.56 -31.65 57.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.632 0.773 . . . . 0.0 110.466 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.19 -32.39 66.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.507 0.723 . . . . 0.0 110.752 173.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -67.4 -49.11 65.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.959 0.904 . . . . 0.0 110.37 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.63 -36.57 84.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.617 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.6 -48.51 85.84 Favored Glycine 0 C--N 1.345 1.049 0 O-C-N 124.124 0.89 . . . . 0.0 112.563 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.512 ' HA ' HG22 ' A' ' 62' ' ' VAL . 15.9 tt -74.64 -31.48 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 116.608 0.204 . . . . 0.0 111.146 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.68 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.972 0.509 . . . . 0.0 110.331 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.0 m -73.37 -47.71 40.0 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.13 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.512 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -62.3 -35.29 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 118.654 0.661 . . . . 0.0 110.741 -177.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.697 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 12.2 ttp180 -66.25 -45.52 80.31 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.173 0.989 . . . . 0.0 110.357 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -67.92 -28.37 67.43 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.784 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.445 ' HB3' HD13 ' A' ' 86' ' ' LEU . 16.0 m120 -100.94 3.53 41.77 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.135 0.974 . . . . 0.0 111.777 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.0 m -63.11 -52.25 63.92 Favored Pre-proline 0 CA--C 1.56 1.346 0 CA-C-O 118.648 -0.691 . . . . 0.0 110.831 172.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.49 -19.46 42.82 Favored 'Trans proline' 0 C--N 1.4 3.238 0 C-N-CA 121.642 1.561 . . . . 0.0 111.65 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 -81.73 77.21 8.6 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 121.944 0.878 . . . . 0.0 109.542 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -66.95 -21.17 65.99 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.166 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -74.43 -31.69 62.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.717 0.807 . . . . 0.0 110.603 174.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -76.51 -25.5 54.25 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.324 0.65 . . . . 0.0 111.74 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.643 ' HE1' HG22 ' A' ' 110' ' ' ILE . 8.3 p90 -107.53 132.96 52.68 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 121.133 0.492 . . . . 0.0 110.407 172.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -97.31 117.11 30.79 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.064 -174.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.465 ' HB3' HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -71.77 104.08 3.31 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.214 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -119.71 151.73 38.29 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.23 1.012 . . . . 0.0 110.6 -169.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.0 m -106.17 124.64 49.91 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.351 0.66 . . . . 0.0 109.755 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 166.24 16.83 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.487 1.115 . . . . 0.0 112.046 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.9 p -64.87 -16.9 63.78 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.06 0.944 . . . . 0.0 112.112 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -90.36 9.71 27.86 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.056 0.943 . . . . 0.0 110.999 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.44 6.85 71.62 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 123.026 0.345 . . . . 0.0 113.758 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 48.2 mmtm -88.98 152.26 21.81 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.069 0.948 . . . . 0.0 110.499 -177.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.409 ' HB3' ' HB2' ' A' ' 106' ' ' ARG . 89.4 m-85 -109.74 126.52 53.82 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.378 0.671 . . . . 0.0 111.017 -170.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.681 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 16.5 p90 -143.97 178.85 7.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.68 1.192 . . . . 0.0 108.538 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.506 ' HE2' HG22 ' A' ' 113' ' ' VAL . 19.6 p90 -146.26 135.08 22.38 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.6 p-10 -116.04 146.12 42.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 65' ' ' ASN . 25.3 tp -119.08 120.35 36.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.667 0.787 . . . . 0.0 109.982 -173.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -91.89 149.96 21.29 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.487 1.115 . . . . 0.0 110.985 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -107.69 176.15 5.25 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.354 1.062 . . . . 0.0 109.554 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.55 -28.2 66.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.56 0.744 . . . . 0.0 111.632 175.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -81.41 5.88 16.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.6 m80 66.24 13.12 9.01 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.685 1.194 . . . . 0.0 111.916 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.77 153.42 17.77 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 124.042 0.937 . . . . 0.0 109.874 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.5 mm -81.85 119.02 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.2 pt -98.17 -8.98 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.187 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.92 111.36 0.33 Allowed Glycine 0 C--N 1.347 1.159 0 O-C-N 123.452 0.47 . . . . 0.0 112.344 175.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 p -114.91 131.6 56.82 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.1 t -85.97 158.19 19.94 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 123.175 0.59 . . . . 0.0 110.261 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -78.41 149.08 33.39 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.681 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.0 ptt? -74.06 117.32 15.72 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.23 0.538 . . . . 0.0 110.662 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -89.45 160.08 16.96 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.602 1.161 . . . . 0.0 111.283 -176.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.437 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -75.84 -52.44 10.36 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.063 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 67.9 p -85.37 142.77 29.06 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.467 -171.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.48 -25.77 64.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.949 0.9 . . . . 0.0 111.191 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -68.56 -36.36 78.66 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 122.98 0.512 . . . . 0.0 110.505 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.2 t -67.96 -23.2 65.02 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.858 0.863 . . . . 0.0 111.309 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.46 ' O ' HG12 ' A' ' 110' ' ' ILE . 55.7 ttp180 -61.28 -56.84 15.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.365 0.666 . . . . 0.0 109.547 172.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -72.94 -32.97 65.64 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.901 0.88 . . . . 0.0 111.753 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.9 m -67.28 -36.09 80.85 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.42 -35.84 63.15 Favored Glycine 0 C--N 1.347 1.187 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.04 176.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.643 HG22 ' HE1' ' A' ' 72' ' ' TYR . 45.4 mm -57.06 -46.9 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.4 0.68 . . . . 0.0 109.419 172.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.95 -37.06 78.62 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.232 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t -67.26 -51.92 47.1 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.059 -174.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.506 HG22 ' HE2' ' A' ' 84' ' ' PHE . 79.6 t -64.9 -31.98 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 123.24 0.616 . . . . 0.0 111.27 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.87 -39.38 94.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.502 0.721 . . . . 0.0 112.026 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -92.51 -43.82 8.96 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.313 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.488 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 59.6 m-20 -83.98 -18.94 35.5 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.997 0.919 . . . . 0.0 111.746 -171.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.8 -27.75 64.25 Favored Glycine 0 C--N 1.341 0.808 0 O-C-N 123.168 0.292 . . . . 0.0 112.886 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.697 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 48.1 p -75.17 -7.83 54.9 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 87.7 p -68.98 -44.22 73.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.379 0.672 . . . . 0.0 111.308 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.452 ' HB2' ' HD3' ' A' ' 63' ' ' ARG . 43.6 tt0 61.9 13.78 5.82 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.028 1.331 . . . . 0.0 111.947 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 m -81.46 89.2 6.13 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.672 -0.643 . . . . 0.0 111.107 -169.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 10.4 m -85.48 112.3 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-O 121.601 0.715 . . . . 0.0 111.728 -176.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -83.03 102.78 11.99 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 164.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.41 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 10.1 p-10 -72.04 95.31 1.59 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.464 1.126 . . . . 0.0 109.826 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -90.7 6.31 44.55 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.604 176.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 p -60.31 89.83 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.592 1.157 . . . . 0.0 110.817 173.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.69 52.22 6.65 Favored Glycine 0 C--N 1.346 1.093 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.653 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.6 t -87.1 -173.76 4.58 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.123 0.569 . . . . 0.0 109.548 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 8.6 t30 . . . . . 0 C--O 1.257 1.467 0 C-N-CA 122.958 0.503 . . . . 0.0 109.777 173.536 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.4 m -64.75 124.54 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 123.75 0.82 . . . . 0.0 110.498 176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.7 pt -81.41 139.87 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 122.972 0.509 . . . . 0.0 110.956 -174.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 80.8 mtp -93.97 96.12 9.49 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.48 90.06 7.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.453 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.446 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . 118.61 136.47 5.43 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.309 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -159.75 164.67 33.64 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.913 0.885 . . . . 0.0 110.272 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -104.47 154.41 19.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.024 0.93 . . . . 0.0 109.643 172.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.508 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.8 mt-10 -136.39 117.89 14.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.084 0.954 . . . . 0.0 109.238 169.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.539 HD22 ' HB2' ' A' ' 52' ' ' LYS . 64.2 tp -81.0 107.1 13.52 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 175.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.9 p -126.85 136.66 52.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.502 0.721 . . . . 0.0 110.946 -170.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -94.66 137.71 33.42 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.696 0.798 . . . . 0.0 108.855 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -93.91 -176.51 4.05 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.766 0.826 . . . . 0.0 111.432 -177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -67.6 -16.33 64.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.029 0.532 . . . . 0.0 110.559 174.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -68.85 -12.78 61.91 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.161 0.984 . . . . 0.0 112.072 174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 69.87 13.26 8.0 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.603 1.161 . . . . 0.0 110.493 -171.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.519 ' HB2' HD11 ' A' ' 48' ' ' LEU . 14.7 mm-40 -108.22 150.62 27.03 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.111 0.964 . . . . 0.0 110.123 -176.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -100.88 128.92 46.71 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.027 0.931 . . . . 0.0 110.585 -169.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.0 ptt85 -143.79 139.63 29.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.617 0.767 . . . . 0.0 109.056 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -94.97 137.09 34.48 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.87 132.33 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 175.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -97.97 114.94 27.19 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -103.69 153.16 20.97 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.597 1.159 . . . . 0.0 110.375 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.8 -175.36 4.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.318 1.047 . . . . 0.0 110.234 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.56 -29.77 72.76 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 113.96 0.344 . . . . 0.0 113.96 -178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -72.58 -21.32 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.026 0.93 . . . . 0.0 111.086 176.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 7.5 59.5 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.204 -173.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -81.39 121.84 26.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.627 0.771 . . . . 0.0 109.748 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 m -70.08 121.64 17.86 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 122.914 0.485 . . . . 0.0 109.905 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.8 pt -100.06 -23.43 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.892 1.277 . . . . 0.0 110.74 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 18.8 tp -145.55 139.64 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.59 0.756 . . . . 0.0 109.574 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.3 m -135.91 125.2 24.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.508 0.723 . . . . 0.0 109.158 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -78.85 170.31 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.554 0.342 . . . . 0.0 110.99 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -74.38 161.64 29.65 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.522 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 30' ' ' GLN . 3.8 mm? -68.75 111.6 4.96 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.038 174.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.401 ' OH ' ' HA ' ' A' ' 94' ' ' ILE . 79.3 m-85 -98.1 151.08 20.75 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.869 0.867 . . . . 0.0 109.992 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.35 -22.47 63.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.357 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.3 t -142.54 153.2 43.36 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.382 0.673 . . . . 0.0 110.705 -176.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.539 ' HB2' HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -69.27 -27.22 65.23 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.654 175.451 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.7 p -60.81 -40.28 92.15 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.824 0.703 . . . . 0.0 110.659 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -65.43 -33.83 76.88 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.241 1.016 . . . . 0.0 111.347 177.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.24 -29.18 60.16 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.218 0.607 . . . . 0.0 111.402 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -74.32 -33.51 63.2 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.624 0.77 . . . . 0.0 110.24 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.5 -34.22 75.51 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.477 169.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -49.87 73.86 Favored Glycine 0 C--N 1.349 1.271 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.714 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.491 ' HA ' HG22 ' A' ' 62' ' ' VAL . 8.0 tt -69.07 -35.56 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 117.037 0.419 . . . . 0.0 110.903 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -36.29 74.66 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.211 0.529 . . . . 0.0 110.289 175.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.9 m -75.76 -44.43 41.63 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.593 177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.491 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.9 m -62.95 -32.42 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-N 119.381 0.991 . . . . 0.0 110.299 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.784 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -68.03 -50.58 54.47 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.383 1.073 . . . . 0.0 109.084 177.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.2 t -63.75 -31.52 72.73 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.093 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -107.5 16.57 23.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.133 0.973 . . . . 0.0 111.898 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -60.13 -52.68 71.64 Favored Pre-proline 0 CA--C 1.566 1.573 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.041 169.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -77.31 -6.13 16.2 Favored 'Trans proline' 0 C--N 1.399 3.226 0 C-N-CA 121.91 1.74 . . . . 0.0 112.435 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -96.22 82.33 3.43 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.69 -24.24 67.54 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.881 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -59.66 -29.99 68.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.885 0.874 . . . . 0.0 111.41 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -24.04 53.78 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.197 0.599 . . . . 0.0 111.384 -175.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -80.41 105.54 11.74 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -96.8 108.9 21.65 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.14 0.576 . . . . 0.0 109.856 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -78.26 117.55 19.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.387 0.675 . . . . 0.0 109.888 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -119.73 142.29 48.66 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.98 0.912 . . . . 0.0 110.398 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.4 m -94.76 111.29 23.08 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.22 154.62 12.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.236 1.014 . . . . 0.0 112.057 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.1 t -63.0 -17.45 62.18 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.024 0.93 . . . . 0.0 111.164 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.38 3.99 11.92 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.709 1.203 . . . . 0.0 111.839 174.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.77 0.06 87.31 Favored Glycine 0 C--N 1.354 1.535 0 C-N-CA 123.276 0.465 . . . . 0.0 112.778 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -87.73 165.29 15.47 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.029 0.931 . . . . 0.0 111.266 -172.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -113.82 129.17 56.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.366 0.666 . . . . 0.0 110.103 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -143.63 176.51 9.16 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.5 p90 -141.87 138.07 31.86 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 122.745 0.418 . . . . 0.0 110.212 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -99.31 166.94 10.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 169.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.613 HD22 HD13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -135.1 121.3 20.15 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 -176.255 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -95.53 173.61 7.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.268 0.627 . . . . 0.0 111.864 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -135.87 174.28 10.79 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.67 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.26 -28.4 69.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.021 0.928 . . . . 0.0 111.386 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -85.97 6.9 26.57 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.556 0.742 . . . . 0.0 111.139 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 69.75 7.21 6.11 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.533 1.133 . . . . 0.0 111.606 -178.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.85 143.1 30.13 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.429 0.692 . . . . 0.0 110.678 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.8 mt -80.5 109.93 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.613 HD13 HD22 ' A' ' 86' ' ' LEU . 23.8 pt -91.42 -1.61 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 124.059 0.944 . . . . 0.0 112.26 -177.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.42 147.76 9.41 Favored Glycine 0 C--O 1.221 -0.695 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.6 p -154.81 129.07 8.98 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.675 0.79 . . . . 0.0 109.198 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.4 t -81.89 161.65 23.06 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -83.78 -78.43 0.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.796 0.438 . . . . 0.0 110.5 -171.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -168.22 121.67 0.89 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.225 0.61 . . . . 0.0 109.806 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -104.02 127.63 51.58 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.598 0.759 . . . . 0.0 109.68 173.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.37 -57.12 7.18 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.223 0.609 . . . . 0.0 109.702 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.499 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 38.8 p -85.5 125.57 33.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.703 174.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.7 -16.1 63.97 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.595 0.758 . . . . 0.0 112.276 -176.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.499 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 12.7 pt20 -65.17 -31.22 72.29 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.438 0.695 . . . . 0.0 110.977 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 m -72.79 -23.38 60.79 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.649 0.78 . . . . 0.0 111.085 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.415 ' O ' HG12 ' A' ' 110' ' ' ILE . 6.3 tmm_? -71.85 -40.72 68.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.66 0.784 . . . . 0.0 108.97 173.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.53 -50.49 71.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.805 0.842 . . . . 0.0 110.596 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.8 m -65.49 -29.97 70.68 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.208 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.9 -44.79 95.54 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.402 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 106' ' ' ARG . 37.3 mm -56.43 -49.18 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.401 0.68 . . . . 0.0 109.791 176.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.43 -36.25 82.34 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.793 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -72.1 -42.21 66.39 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.693 0.797 . . . . 0.0 110.52 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 71.0 t -70.19 -32.8 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.605 0.762 . . . . 0.0 110.76 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -67.46 -43.14 81.81 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.114 0.565 . . . . 0.0 110.572 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.15 -45.37 66.93 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.929 0.892 . . . . 0.0 111.47 -177.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.446 ' ND2' ' HA3' ' A' ' 19' ' ' GLY . 22.4 m120 -93.88 -1.85 54.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.2 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.62 -29.62 65.37 Favored Glycine 0 C--N 1.343 0.922 0 N-CA-C 111.996 -0.441 . . . . 0.0 111.996 174.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.784 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 14.7 t -88.63 5.71 41.71 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.803 0.841 . . . . 0.0 111.664 177.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.4 m -82.59 109.28 16.64 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.109 0.564 . . . . 0.0 109.695 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -86.5 74.63 9.88 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 122.031 0.92 . . . . 0.0 108.781 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.0 m -147.12 94.72 2.45 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.094 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 m -105.28 140.32 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.508 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 28.9 mtmm -107.76 117.63 34.62 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 170.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.83 94.59 1.06 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 175.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.42 -18.8 40.6 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.678 178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 40.2 p -63.09 93.29 0.06 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.335 1.054 . . . . 0.0 110.827 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.5 -36.82 3.71 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.823 -175.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 46.8 m -74.9 109.2 8.16 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.354 0.662 . . . . 0.0 110.432 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 12.3 m120 . . . . . 0 C--O 1.248 1.006 0 C-N-CA 123.486 0.714 . . . . 0.0 109.319 178.398 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.477 0 N-CA-C 112.293 -0.323 . . . . 0.0 112.293 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.3 m -109.46 152.43 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.842 0.857 . . . . 0.0 109.568 174.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 16.2 pt -95.84 88.26 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 122.098 0.952 . . . . 0.0 110.822 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.93 107.79 18.87 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.959 173.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.31 149.09 30.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.311 0.644 . . . . 0.0 110.776 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.99 145.79 23.65 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.761 0.663 . . . . 0.0 111.99 175.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -130.94 151.32 51.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.526 0.73 . . . . 0.0 110.742 -175.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -90.26 155.02 19.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.543 168.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.559 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 41.3 mt-10 -132.46 124.5 28.7 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.504 HD12 ' HB3' ' A' ' 31' ' ' PHE . 37.4 tp -79.7 99.5 7.44 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 p -106.57 156.85 18.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.28 1.432 . . . . 0.0 109.139 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HB3' HG21 ' A' ' 126' ' ' THR . 21.6 ptmt -118.31 160.81 20.98 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.511 0.725 . . . . 0.0 109.869 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.3 t -120.39 177.81 4.89 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.457 0.703 . . . . 0.0 109.457 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -71.68 -8.52 54.65 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.142 0.577 . . . . 0.0 111.1 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.73 -4.2 33.06 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.201 1.0 . . . . 0.0 111.589 170.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 40.2 t-20 77.69 -12.94 1.01 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 125.614 1.565 . . . . 0.0 110.724 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -83.5 156.62 22.75 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.218 1.007 . . . . 0.0 112.111 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.504 ' HB3' HD12 ' A' ' 23' ' ' LEU . 27.0 m-85 -97.7 151.55 20.02 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.172 -175.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -156.95 155.88 32.08 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.627 0.771 . . . . 0.0 109.442 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -102.3 131.53 48.82 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.017 0.527 . . . . 0.0 109.767 173.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.56 130.55 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.37 108.75 21.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -177.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -97.87 130.69 44.76 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.84 178.06 1.47 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.182 0.593 . . . . 0.0 110.806 172.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.58 -18.14 55.41 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-O 121.025 0.236 . . . . 0.0 113.261 174.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -74.21 -14.38 60.93 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 111.578 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.35 12.75 80.08 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.649 -172.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -98.38 124.31 42.98 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.529 0.732 . . . . 0.0 110.568 -175.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.6 m -70.48 121.51 17.91 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.409 HD13 ' HG ' ' A' ' 112' ' ' SER . 25.1 pt -109.44 -34.75 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.038 0.935 . . . . 0.0 110.499 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.7 tp -137.02 151.2 48.69 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -145.98 112.99 6.1 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.414 0.686 . . . . 0.0 110.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.4 m -58.39 156.18 10.65 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.983 0.913 . . . . 0.0 111.178 173.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.453 ' CG ' ' HB ' ' A' ' 93' ' ' ILE . 23.1 mm-40 -66.91 169.22 8.5 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.266 0.555 . . . . 0.0 111.917 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.34 111.95 11.14 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.612 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.46 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 63.8 m-85 -104.7 132.92 50.37 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.58 1.552 . . . . 0.0 109.31 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.6 p -62.07 -34.73 76.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.145 0.978 . . . . 0.0 111.589 -175.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m -122.45 152.82 39.88 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.57 1.148 . . . . 0.0 109.563 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -27.3 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.809 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.8 t -72.09 -28.23 63.16 Favored 'General case' 0 C--N 1.36 1.048 0 O-C-N 123.56 0.538 . . . . 0.0 111.35 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.46 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.3 m -71.38 -33.07 69.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.424 0.63 . . . . 0.0 109.79 174.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.21 -34.24 59.26 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.649 172.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -67.4 -42.69 82.9 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.423 1.089 . . . . 0.0 110.918 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.085 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.68 -49.84 74.17 Favored Glycine 0 C--N 1.356 1.662 0 O-C-N 123.987 0.805 . . . . 0.0 112.695 177.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.404 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.3 tt -70.23 -35.86 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 122.196 0.198 . . . . 0.0 111.066 177.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.64 75.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.856 0.462 . . . . 0.0 110.746 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.9 m -76.0 -41.4 51.25 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.858 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.4 m -66.03 -30.82 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-N 119.028 0.831 . . . . 0.0 110.355 178.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -64.07 -39.63 94.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.139 1.375 . . . . 0.0 111.091 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 t -89.25 -28.49 19.89 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.315 0.646 . . . . 0.0 111.314 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -97.22 3.39 51.44 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.181 0.592 . . . . 0.0 112.076 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.627 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 11.7 p -69.43 -40.66 15.1 Favored Pre-proline 0 CA--C 1.568 1.66 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.854 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.48 -39.32 28.98 Favored 'Trans proline' 0 C--N 1.402 3.347 0 CA-C-N 121.484 1.566 . . . . 0.0 111.384 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -79.97 80.52 6.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.928 0.891 . . . . 0.0 110.235 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.493 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 12.4 pt-20 -68.13 -8.17 36.09 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.314 0.578 . . . . 0.0 111.868 174.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.64 -35.82 22.53 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.949 1.7 . . . . 0.0 112.217 165.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -85.28 -8.72 58.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.554 0.742 . . . . 0.0 112.41 -172.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -88.15 123.37 32.73 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.827 0.851 . . . . 0.0 109.179 177.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.7 96.79 9.23 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 170.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -85.58 121.53 28.4 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.556 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -145.23 142.5 29.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.457 0.703 . . . . 0.0 109.983 -173.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.6 m -99.82 130.05 45.98 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.145 0.578 . . . . 0.0 109.527 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.25 170.27 10.55 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.68 1.192 . . . . 0.0 111.845 178.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 m -64.55 -30.06 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.717 0.807 . . . . 0.0 111.464 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -72.77 -11.69 60.71 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.331 0.653 . . . . 0.0 112.146 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.17 18.4 53.56 Favored Glycine 0 C--N 1.344 0.996 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.5 mmtp -84.88 121.82 28.29 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.309 0.644 . . . . 0.0 110.222 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.454 ' HB2' ' HB2' ' A' ' 100' ' ' TYR . 73.8 m-85 -80.76 133.96 35.74 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.431 0.692 . . . . 0.0 109.76 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -152.22 173.66 14.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.458 0.647 . . . . 0.0 110.202 173.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -147.16 142.57 27.46 Favored 'General case' 0 C--O 1.246 0.912 0 C-N-CA 124.89 1.276 . . . . 0.0 108.213 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -117.18 110.6 18.35 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 174.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.672 HD22 HD13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -77.9 128.03 33.3 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 178.759 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.565 ' HE2' HG12 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -113.55 145.45 41.21 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.788 0.835 . . . . 0.0 110.126 -171.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.79 170.64 10.25 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.958 0.903 . . . . 0.0 109.613 171.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.98 61.27 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.156 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.13 2.56 56.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.092 0.957 . . . . 0.0 111.512 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 67.8 17.58 9.74 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.797 1.239 . . . . 0.0 112.439 -175.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -79.34 126.65 31.08 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.565 HG12 ' HE2' ' A' ' 87' ' ' LYS . 39.8 mt -73.58 96.87 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.672 HD13 HD22 ' A' ' 86' ' ' LEU . 13.9 pt -79.95 -13.33 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.86 -175.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -158.73 129.91 2.38 Favored Glycine 0 C--O 1.218 -0.853 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 173.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.3 t -134.2 112.43 11.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.8 p -71.0 140.42 50.81 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -77.12 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 124.277 0.986 . . . . 0.0 110.11 -168.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.55 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 20.8 ptp -171.61 134.67 0.84 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.258 1.023 . . . . 0.0 108.732 168.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.454 ' HB2' ' HB2' ' A' ' 82' ' ' PHE . 24.0 m-85 -105.13 136.65 44.24 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.062 0.945 . . . . 0.0 110.258 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -92.33 -24.83 18.8 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.114 0.566 . . . . 0.0 110.618 174.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.444 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 74.0 p -115.07 132.53 56.57 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.66 0.784 . . . . 0.0 110.049 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.05 -20.28 29.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.578 0.751 . . . . 0.0 110.941 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.444 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 14.0 pt20 -67.23 -33.77 76.07 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.861 0.864 . . . . 0.0 111.886 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.501 ' HB2' ' NH1' ' A' ' 106' ' ' ARG . 20.6 m -72.88 -18.46 61.42 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.111 0.564 . . . . 0.0 111.71 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.501 ' NH1' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER -59.99 -26.93 66.44 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.342 1.057 . . . . 0.0 112.473 178.416 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.5 -49.4 77.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.521 0.728 . . . . 0.0 110.472 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.5 m -76.23 -35.02 59.21 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.852 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.45 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -64.57 -51.94 47.55 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.874 -173.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.3 mm -59.17 -41.65 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 123.919 0.888 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.11 90.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.107 0.563 . . . . 0.0 110.967 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.409 ' HG ' HD13 ' A' ' 43' ' ' ILE . 27.3 t -73.77 -30.26 62.67 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.43 0.692 . . . . 0.0 111.721 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 109' ' ' GLY . 79.5 t -74.22 -35.5 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 122.567 0.347 . . . . 0.0 110.102 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.627 ' HA ' ' HB2' ' A' ' 66' ' ' SER . 68.7 mttm -70.65 -48.1 56.63 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.474 0.31 . . . . 0.0 111.089 174.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.49 -51.14 31.05 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.59 0.756 . . . . 0.0 111.967 -174.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -95.92 -7.47 36.57 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.182 0.593 . . . . 0.0 111.483 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.27 -21.08 71.02 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.084 0.24 . . . . 0.0 112.873 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.9 p -81.74 -1.45 47.13 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.372 0.669 . . . . 0.0 111.748 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.2 m -75.25 135.48 40.97 Favored 'General case' 0 C--N 1.348 0.541 0 C-N-CA 122.711 0.404 . . . . 0.0 110.941 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -3.28 58.07 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.306 0.642 . . . . 0.0 110.47 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 35.3 m -65.86 101.93 0.71 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.215 1.006 . . . . 0.0 110.847 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 16.0 m -117.91 142.12 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.559 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 14.2 tmtt? -122.09 139.69 53.41 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.01 124.09 27.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.394 0.616 . . . . 0.0 111.659 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -132.63 -18.8 2.42 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.614 0.766 . . . . 0.0 109.944 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.517 HG21 ' HB3' ' A' ' 25' ' ' LYS . 8.4 p -62.66 101.09 0.22 Allowed 'General case' 0 C--N 1.36 1.062 0 C-N-CA 124.659 1.184 . . . . 0.0 111.004 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.32 -2.5 66.22 Favored Glycine 0 C--N 1.343 0.961 0 CA-C-N 115.582 -0.735 . . . . 0.0 113.21 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 m -86.59 73.23 10.11 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.7 m120 . . . . . 0 C--O 1.247 0.921 0 CA-C-N 114.843 -1.072 . . . . 0.0 108.511 -170.875 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.149 0 N-CA-C 112.28 -0.328 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.9 m -89.88 158.33 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 123.229 0.612 . . . . 0.0 109.467 174.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.4 pt -85.62 138.66 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.24 178.36 4.39 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.394 1.078 . . . . 0.0 109.362 176.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -132.08 122.9 26.16 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.526 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . 96.48 128.22 5.71 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.574 0.546 . . . . 0.0 113.326 174.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 31.7 p90 -137.49 148.65 46.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.063 0.945 . . . . 0.0 110.058 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -91.67 147.23 23.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.208 1.003 . . . . 0.0 108.859 170.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.533 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 42.9 mt-10 -133.75 116.37 15.67 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.471 0.709 . . . . 0.0 109.446 175.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.545 HD12 ' HB3' ' A' ' 31' ' ' PHE . 32.6 tp -83.25 99.51 10.02 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.381 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.9 p -108.84 147.59 31.88 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.329 1.052 . . . . 0.0 109.31 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -95.78 143.69 26.8 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 173.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.5 p -86.73 -172.34 3.96 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.209 1.003 . . . . 0.0 111.159 -176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.27 -19.85 64.74 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 122.803 0.441 . . . . 0.0 110.437 171.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -84.11 -1.09 54.32 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.016 0.927 . . . . 0.0 111.948 174.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.5 t30 69.96 9.77 7.22 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 124.73 1.212 . . . . 0.0 110.702 -175.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -88.3 154.4 20.44 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.589 0.756 . . . . 0.0 111.448 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.545 ' HB3' HD12 ' A' ' 23' ' ' LEU . 94.4 m-85 -89.79 125.15 35.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.247 1.019 . . . . 0.0 110.568 -171.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -137.56 130.33 30.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.922 1.289 . . . . 0.0 108.936 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -91.3 132.48 36.12 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.138 0.575 . . . . 0.0 109.638 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.475 HG12 HG21 ' A' ' 45' ' ' THR . 25.8 m -113.71 131.05 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 167.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 26.0 tp -101.7 110.26 22.21 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 177.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 61.2 mttp -100.4 143.17 30.9 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.849 0.86 . . . . 0.0 108.89 172.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.26 173.44 4.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.209 0.604 . . . . 0.0 110.144 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.15 -19.04 61.16 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.638 -0.255 . . . . 0.0 112.992 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.04 -4.08 39.37 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.295 1.038 . . . . 0.0 112.362 175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.42 4.25 89.03 Favored Glycine 0 C--N 1.348 1.232 0 CA-C-O 120.891 0.162 . . . . 0.0 112.842 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -90.19 113.29 25.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.439 1.096 . . . . 0.0 109.24 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 22.1 m -61.84 129.52 41.34 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 122.837 0.455 . . . . 0.0 109.821 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.5 pt -115.8 -22.12 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 124.426 1.091 . . . . 0.0 110.581 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.4 tp -150.97 143.77 24.49 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.335 1.054 . . . . 0.0 108.319 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.475 HG21 HG12 ' A' ' 34' ' ' VAL . 96.3 m -139.55 112.15 7.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.6 0.76 . . . . 0.0 109.235 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.4 t -68.68 166.1 18.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.857 0.863 . . . . 0.0 110.542 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -89.27 -172.51 3.66 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.82 119.66 26.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.76 0.824 . . . . 0.0 110.984 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.418 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.0 m-85 -109.19 133.18 53.36 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.014 0.925 . . . . 0.0 108.95 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 70.3 p -61.04 -41.27 96.26 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.114 0.566 . . . . 0.0 110.972 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -119.73 148.48 43.36 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.321 1.048 . . . . 0.0 109.738 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 16.4 ptpt -68.31 -27.03 65.93 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.433 0.293 . . . . 0.0 110.948 177.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.1 p -55.71 -37.63 68.66 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.737 0.815 . . . . 0.0 111.311 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 12.6 m -70.29 -38.92 75.11 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.907 0.883 . . . . 0.0 110.448 174.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.59 -28.53 67.84 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.471 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 52' ' ' LYS . 67.3 mm-40 -68.35 -38.89 81.9 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.239 0.616 . . . . 0.0 109.916 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 -31.67 70.72 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.294 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.403 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -65.34 -49.15 62.69 Favored Glycine 0 C--N 1.344 0.99 0 O-C-N 123.975 0.797 . . . . 0.0 113.061 177.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.415 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.3 tt -72.52 -31.88 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 122.672 0.389 . . . . 0.0 110.977 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.9 85.4 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.673 0.389 . . . . 0.0 110.129 173.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.7 m -69.81 -47.15 63.88 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.836 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.415 HG21 ' HA ' ' A' ' 59' ' ' ILE . 15.1 m -61.79 -34.22 61.44 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 CA-C-N 119.146 0.885 . . . . 0.0 111.618 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.29 -33.41 49.44 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 123.299 0.639 . . . . 0.0 109.727 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.7 t -75.18 -26.29 58.93 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.823 0.849 . . . . 0.0 111.097 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.18 0.63 43.76 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.266 1.026 . . . . 0.0 110.993 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.7 t -67.34 -40.0 24.1 Favored Pre-proline 0 CA--C 1.566 1.576 0 C-N-CA 123.007 0.523 . . . . 0.0 111.837 175.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -72.38 -23.85 20.06 Favored 'Trans proline' 0 C--N 1.39 2.723 0 C-N-CA 121.756 1.637 . . . . 0.0 113.229 166.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -79.94 90.87 5.36 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.914 0.485 . . . . 0.0 110.356 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 72' ' ' TYR . 11.6 pt-20 -64.93 -24.17 67.44 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.015 0.926 . . . . 0.0 111.776 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.29 -14.47 62.61 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.978 0.911 . . . . 0.0 112.557 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.424 ' HA ' ' HE ' ' A' ' 71' ' ' ARG . 7.7 mmp_? -91.14 -24.04 20.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.769 0.428 . . . . 0.0 110.762 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.402 ' HD2' ' HA ' ' A' ' 69' ' ' GLU . 89.6 m-85 -75.46 95.78 3.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.614 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -96.12 106.18 18.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.705 0.802 . . . . 0.0 109.857 -174.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB3' ' NE ' ' A' ' 106' ' ' ARG . 62.4 pttt -91.19 123.41 34.62 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.185 0.517 . . . . 0.0 111.223 -177.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.63 168.97 16.25 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.738 0.815 . . . . 0.0 109.494 175.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 7.4 m -100.4 112.65 25.02 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.23 163.05 1.23 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.464 1.106 . . . . 0.0 112.284 174.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 80.7 p -62.52 -20.26 64.44 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.373 0.669 . . . . 0.0 111.318 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -81.38 2.58 27.83 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.852 1.261 . . . . 0.0 111.882 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.33 19.3 79.64 Favored Glycine 0 C--N 1.353 1.49 0 C-N-CA 122.973 0.32 . . . . 0.0 113.455 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 99' ' ' MET . 73.3 mmtt -106.81 155.79 19.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.581 0.752 . . . . 0.0 110.125 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -104.76 128.85 53.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.878 0.471 . . . . 0.0 109.834 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.552 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 2.0 p90 -148.84 174.34 12.32 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.561 ' HB3' ' HE ' ' A' ' 106' ' ' ARG . 43.8 p90 -130.19 136.12 48.9 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.026 0.53 . . . . 0.0 111.805 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -103.45 115.37 30.41 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 170.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 24.0 tp -80.1 113.62 18.41 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 173.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.437 ' HE2' HG12 ' A' ' 93' ' ' ILE . 35.1 mmtp -97.39 164.11 12.59 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.005 0.922 . . . . 0.0 111.226 -175.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.79 175.27 5.55 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.253 1.021 . . . . 0.0 110.861 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.93 -26.07 65.79 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.131 0.972 . . . . 0.0 111.101 175.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -88.11 12.03 14.67 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.878 0.871 . . . . 0.0 110.946 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 65.2 15.77 10.19 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.821 1.248 . . . . 0.0 112.335 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -82.45 151.14 26.68 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.447 0.699 . . . . 0.0 110.13 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.437 HG12 ' HE2' ' A' ' 87' ' ' LYS . 46.9 mt -87.69 97.57 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.1 pt -85.45 -10.58 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.737 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -165.66 117.12 0.73 Allowed Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.6 p -103.89 113.95 27.85 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 169.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 37.5 t -73.66 166.54 23.09 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.203 0.525 . . . . 0.0 110.926 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -74.35 147.72 41.94 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.318 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.552 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.94 118.19 17.63 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -95.88 163.5 13.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.773 0.829 . . . . 0.0 110.666 -176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.2 57.21 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.534 0.734 . . . . 0.0 111.253 -177.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.0 p -128.25 175.87 8.12 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.639 -178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.99 -20.52 61.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.025 0.93 . . . . 0.0 110.917 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -74.93 -42.76 57.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.832 0.853 . . . . 0.0 110.473 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.9 p -69.26 -22.11 63.85 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.822 0.449 . . . . 0.0 111.055 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.561 ' HE ' ' HB3' ' A' ' 84' ' ' PHE . 13.8 ttt180 -62.4 -41.81 98.96 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.626 0.37 . . . . 0.0 110.526 170.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -64.78 -36.1 83.24 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.256 0.622 . . . . 0.0 111.033 -177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.0 m -64.13 -36.85 85.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.881 171.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.88 -31.23 67.3 Favored Glycine 0 C--N 1.353 1.488 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.507 176.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.68 -49.57 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.93 -34.96 77.04 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.429 -1.259 . . . . 0.0 111.379 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t -69.1 -53.12 21.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.202 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.18 -31.56 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.628 0.771 . . . . 0.0 111.229 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -69.92 -50.5 41.5 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.362 0.665 . . . . 0.0 110.972 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.38 -19.25 36.42 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.394 0.678 . . . . 0.0 112.811 -173.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.526 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 91.0 m-20 -100.82 -30.77 11.51 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.647 0.779 . . . . 0.0 110.443 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.88 -17.26 77.53 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 116.089 -0.505 . . . . 0.0 113.62 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -71.18 -14.95 62.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.421 0.689 . . . . 0.0 111.65 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 98.2 p -65.68 -43.27 89.78 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 123.233 0.613 . . . . 0.0 110.223 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 59.25 19.78 7.89 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.705 1.202 . . . . 0.0 111.017 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.1 m -90.17 105.31 17.72 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.208 1.003 . . . . 0.0 109.457 -174.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.99 144.35 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 O-C-N 123.636 0.585 . . . . 0.0 110.895 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.533 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 25.8 mtpp -117.72 100.59 7.7 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 173.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.01 97.78 1.2 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.614 0.721 . . . . 0.0 109.49 -178.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.89 8.39 44.5 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.939 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 49.9 p -67.11 116.63 8.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.193 0.597 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 112.58 -48.8 0.9 Allowed Glycine 0 C--N 1.346 1.092 0 N-CA-C 111.316 -0.713 . . . . 0.0 111.316 -175.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.4 m -88.8 74.95 8.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.332 0.653 . . . . 0.0 109.446 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.431 ' N ' HD21 ' A' ' 129' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.366 -172.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.437 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -83.47 153.77 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.13 0.572 . . . . 0.0 110.446 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.6 pt -105.67 170.06 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.469 0.708 . . . . 0.0 110.168 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.6 mmt -74.53 94.99 2.7 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 173.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.62 74.53 10.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.284 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.26 155.06 9.9 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.173 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 36.1 p90 -154.81 167.14 31.24 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.831 0.852 . . . . 0.0 109.228 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -110.11 133.88 52.75 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.336 0.654 . . . . 0.0 110.035 177.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -98.77 106.13 18.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 165.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.27 128.74 34.96 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -147.02 166.41 26.92 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.823 0.449 . . . . 0.0 109.802 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -109.33 141.33 41.82 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.567 0.747 . . . . 0.0 109.189 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -86.49 -168.58 2.29 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.826 0.851 . . . . 0.0 111.306 -176.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.2 m -60.23 -27.29 67.08 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.614 0.765 . . . . 0.0 112.375 -179.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HB3' ' HG2' ' A' ' 30' ' ' GLN . 19.4 t70 -102.23 14.55 31.64 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.844 0.857 . . . . 0.0 110.494 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 62.04 17.84 9.42 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.567 1.147 . . . . 0.0 112.088 -173.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 28' ' ' ASP . 33.5 mm-40 -71.54 141.69 50.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.474 0.71 . . . . 0.0 110.058 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -90.77 115.72 28.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.401 0.681 . . . . 0.0 109.879 -165.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HB2' HD22 ' A' ' 48' ' ' LEU . 8.3 tpp180 -140.37 120.46 13.74 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.654 1.182 . . . . 0.0 108.36 -172.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -109.33 138.26 45.96 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.428 0.291 . . . . 0.0 110.345 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.57 132.8 54.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 173.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 13.8 tp -88.39 119.33 28.71 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -105.64 140.15 39.15 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.376 1.071 . . . . 0.0 109.076 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.24 178.5 5.09 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.373 0.669 . . . . 0.0 110.824 173.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -67.51 -17.29 68.55 Favored Glycine 0 C--N 1.35 1.35 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 174.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -66.77 -23.52 66.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.781 0.833 . . . . 0.0 110.946 170.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.35 -7.39 68.92 Favored Glycine 0 C--N 1.349 1.27 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.443 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -90.35 138.75 31.28 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.102 0.961 . . . . 0.0 110.531 -174.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.1 m -69.48 123.93 22.56 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.539 0.736 . . . . 0.0 110.889 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.401 HD12 ' HG ' ' A' ' 35' ' ' LEU . 25.9 pt -111.86 -19.87 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.578 1.151 . . . . 0.0 111.007 -178.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -156.01 154.91 31.81 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -173.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 96.5 m -155.86 129.19 8.23 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 125.184 1.394 . . . . 0.0 107.793 -176.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 83.2 p -72.75 -170.89 0.76 Allowed 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.677 0.671 . . . . 0.0 111.718 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -91.88 178.51 5.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.734 0.413 . . . . 0.0 110.833 165.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.412 HD22 ' HB2' ' A' ' 32' ' ' ARG . 72.8 mt -77.08 113.69 15.07 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.012 174.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -89.72 141.24 28.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.949 170.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 46.3 p -83.2 -11.61 57.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.176 0.59 . . . . 0.0 110.866 176.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.8 m -135.1 135.74 41.43 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.214 1.006 . . . . 0.0 110.285 177.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -28.16 69.61 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.871 0.868 . . . . 0.0 111.401 175.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.6 p -70.2 -31.66 69.22 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.453 0.701 . . . . 0.0 111.092 175.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -70.87 -27.99 64.24 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.611 0.364 . . . . 0.0 110.54 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.15 67.39 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.54 0.736 . . . . 0.0 111.355 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.413 ' HA ' HG22 ' A' ' 59' ' ' ILE . 0.3 OUTLIER -74.23 -29.37 61.68 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 176.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.15 -37.27 86.85 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 166.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.41 -48.91 78.74 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.009 0.818 . . . . 0.0 113.438 -178.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.413 HG22 ' HA ' ' A' ' 56' ' ' GLU . 10.5 tt -66.68 -33.59 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 120.878 0.371 . . . . 0.0 110.751 177.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.74 81.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.12 0.568 . . . . 0.0 110.703 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.1 m -75.55 -42.04 53.38 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.438 0.695 . . . . 0.0 111.878 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.9 m -66.06 -32.1 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.507 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 51.5 ttp180 -65.43 -47.06 77.51 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.417 1.087 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.3 t -64.1 -26.4 68.53 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.141 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.482 HD21 HD11 ' A' ' 94' ' ' ILE . 87.5 m-20 -105.88 10.85 32.35 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.921 0.888 . . . . 0.0 112.511 -174.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.4 m -65.22 -46.87 72.26 Favored Pre-proline 0 CA--C 1.564 1.492 0 CA-C-O 118.525 -0.75 . . . . 0.0 112.054 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.79 -14.13 14.1 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.719 1.613 . . . . 0.0 112.763 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -80.12 94.62 6.02 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.276 0.63 . . . . 0.0 109.454 -177.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.04 -35.6 75.46 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.702 0.801 . . . . 0.0 111.881 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -61.5 -27.34 68.52 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.776 0.83 . . . . 0.0 111.71 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -87.57 -29.76 21.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -171.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.566 ' HB3' ' HG ' ' A' ' 86' ' ' LEU . 14.2 p90 -115.42 125.63 53.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 119.448 1.022 . . . . 0.0 109.161 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -137.91 137.76 38.35 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.515 0.726 . . . . 0.0 110.398 -173.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.461 ' HA ' ' HD1' ' A' ' 84' ' ' PHE . 2.3 ptmm? -76.62 105.12 7.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.251 171.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -91.35 164.68 13.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.707 1.203 . . . . 0.0 110.737 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -127.52 123.76 36.64 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.771 0.828 . . . . 0.0 108.885 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.12 165.54 20.11 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.435 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -60.48 -26.1 66.54 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.98 0.912 . . . . 0.0 111.46 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -84.37 -4.18 58.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.826 0.85 . . . . 0.0 111.636 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.02 62.12 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 122.91 0.291 . . . . 0.0 113.075 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 32.9 mmtp -71.98 129.94 39.76 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.269 0.627 . . . . 0.0 111.446 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -77.49 144.11 37.98 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.366 177.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -151.69 169.24 22.66 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.461 ' HD1' ' HA ' ' A' ' 74' ' ' LYS . 20.4 m-85 -105.25 160.13 15.33 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 122.12 -0.363 . . . . 0.0 110.079 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -140.23 103.78 4.67 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 168.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.566 ' HG ' ' HB3' ' A' ' 72' ' ' TYR . 1.4 tt -86.65 109.24 19.05 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -87.68 154.58 20.47 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.404 1.482 . . . . 0.0 110.655 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.46 166.3 10.65 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.55 1.14 . . . . 0.0 110.008 174.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -21.49 66.56 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.524 0.73 . . . . 0.0 111.661 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -86.09 10.69 13.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.123 0.969 . . . . 0.0 111.404 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.0 m80 62.85 25.29 15.01 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 177.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -115.08 156.77 24.58 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.212 1.005 . . . . 0.0 109.631 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.9 mt -87.72 121.28 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 122.818 0.447 . . . . 0.0 110.108 -176.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.482 HD11 HD21 ' A' ' 65' ' ' ASN . 17.6 pt -106.15 -4.95 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.071 0.948 . . . . 0.0 110.51 174.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -154.07 139.34 6.74 Favored Glycine 0 C--N 1.345 1.071 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 84' ' ' PHE . 77.8 p -159.47 169.72 23.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.221 1.408 . . . . 0.0 108.67 -177.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.4 t -132.87 165.39 24.74 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.553 -0.717 . . . . 0.0 110.537 174.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -72.5 -72.97 0.21 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.94 0.896 . . . . 0.0 109.454 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.55 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 22.5 ptp -175.87 139.87 0.41 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.301 1.04 . . . . 0.0 109.993 175.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -104.71 104.16 13.91 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.46 1.104 . . . . 0.0 108.863 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.58 -39.46 84.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.537 0.735 . . . . 0.0 110.893 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.7 p -90.01 133.6 34.72 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.857 173.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.1 -31.76 69.48 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.55 1.14 . . . . 0.0 112.673 -172.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.25 -28.58 68.83 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.458 0.703 . . . . 0.0 111.764 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 41.7 m -64.25 -22.44 66.95 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.882 0.873 . . . . 0.0 112.473 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.406 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.3 ptt180 -69.01 -39.56 79.22 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.37 -50.74 13.43 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.563 0.745 . . . . 0.0 110.103 -176.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.3 m -59.47 -38.35 80.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.994 0.918 . . . . 0.0 110.959 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.82 -35.66 92.18 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.252 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.424 HG22 ' HE2' ' A' ' 72' ' ' TYR . 26.4 mm -58.46 -48.3 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 CA-C-N 117.456 0.628 . . . . 0.0 110.852 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.64 -38.51 90.54 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.135 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -70.84 -42.96 69.47 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.01 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 70.5 t -65.78 -39.01 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.843 0.857 . . . . 0.0 110.391 179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -64.14 -39.46 94.06 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.674 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.23 -36.68 39.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.658 0.783 . . . . 0.0 112.59 -176.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.97 -8.84 17.38 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.074 0.55 . . . . 0.0 111.83 -169.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.04 -34.37 86.57 Favored Glycine 0 C--N 1.346 1.094 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.507 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 15.3 t -75.89 -5.75 47.56 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 124.01 0.924 . . . . 0.0 111.91 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.2 t -65.5 141.66 58.4 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.831 0.453 . . . . 0.0 109.808 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -121.44 8.2 10.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.342 1.057 . . . . 0.0 110.948 -172.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.2 t -97.04 115.84 28.18 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.39 131.33 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.825 0.85 . . . . 0.0 110.199 -178.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -92.32 110.28 21.67 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.631 0.772 . . . . 0.0 109.17 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -83.44 102.86 12.35 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.986 0.898 . . . . 0.0 110.159 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -91.77 -3.38 56.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.512 1.125 . . . . 0.0 110.21 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 27.0 p -73.17 109.09 6.44 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.034 0.933 . . . . 0.0 110.882 178.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 87.92 24.7 34.25 Favored Glycine 0 C--N 1.347 1.163 0 CA-C-N 116.149 -0.478 . . . . 0.0 113.435 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.2 m -67.78 103.19 1.36 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.912 0.485 . . . . 0.0 111.077 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 39.2 t30 . . . . . 0 C--O 1.25 1.118 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 171.205 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 112.053 -0.419 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.2 m -112.06 145.58 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.807 0.843 . . . . 0.0 110.303 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.0 pt -72.25 127.12 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 0.0 109.532 173.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.449 ' HE1' ' HA ' ' A' ' 119' ' ' SER . 24.2 ptm -163.57 161.97 24.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.885 0.474 . . . . 0.0 110.83 -172.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.08 149.82 25.52 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.878 0.871 . . . . 0.0 110.316 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.51 135.58 4.17 Favored Glycine 0 C--N 1.341 0.855 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.239 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -153.05 150.61 29.34 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 123.873 0.869 . . . . 0.0 110.136 -178.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -87.05 143.46 27.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.213 177.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -129.71 111.72 12.93 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.0 tp -79.68 98.37 6.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.2 m -105.92 136.22 45.95 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.241 -170.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HB3' HG23 ' A' ' 126' ' ' THR . 19.4 ptmt -94.75 133.34 38.55 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 170.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 45.9 m -79.29 179.52 7.36 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.648 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.0 t -58.2 -37.98 75.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.046 0.538 . . . . 0.0 111.458 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -92.55 22.52 4.6 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 123.811 0.845 . . . . 0.0 110.77 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 64.31 19.59 11.85 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.513 1.125 . . . . 0.0 112.817 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -77.59 120.75 22.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.16 0.584 . . . . 0.0 109.692 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.401 ' O ' ' HB2' ' A' ' 49' ' ' TYR . 50.1 m-85 -89.52 124.2 34.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.645 0.778 . . . . 0.0 109.594 -170.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HB2' ' HB2' ' A' ' 46' ' ' SER . 35.9 ptt180 -157.29 158.09 35.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.353 0.661 . . . . 0.0 109.877 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.471 ' HE2' HG23 ' A' ' 122' ' ' VAL . 16.7 m-85 -91.31 141.23 29.0 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.93 0.492 . . . . 0.0 109.805 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.8 m -120.67 131.26 73.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 167.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -97.34 111.8 23.89 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -90.41 138.29 31.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.5 176.0 5.07 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.481 0.712 . . . . 0.0 110.135 169.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -60.19 -24.36 60.94 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 114.088 0.395 . . . . 0.0 114.088 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -81.26 0.4 36.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.291 1.037 . . . . 0.0 112.173 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.3 -0.71 89.55 Favored Glycine 0 C--N 1.353 1.512 0 C-N-CA 122.803 0.24 . . . . 0.0 113.599 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -88.21 130.56 35.04 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.455 0.702 . . . . 0.0 110.336 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.8 m -71.95 121.9 19.89 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.294 0.638 . . . . 0.0 110.287 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 pt -102.58 -32.08 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.452 1.101 . . . . 0.0 110.815 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 34.6 tp -132.18 149.45 52.39 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.993 0.917 . . . . 0.0 109.662 -172.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 91.6 m -152.99 125.77 8.35 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.411 1.084 . . . . 0.0 109.462 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.589 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 5.6 m -66.97 170.79 6.2 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.011 0.924 . . . . 0.0 110.583 175.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.1 168.11 20.62 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -71.3 112.48 7.47 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 84.9 m-85 -104.95 137.16 43.14 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 m -73.99 -28.74 61.61 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.161 0.505 . . . . 0.0 110.092 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.48 ' HB3' HG23 ' A' ' 53' ' ' THR . 17.6 m -105.32 132.59 51.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.624 0.77 . . . . 0.0 110.151 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -26.84 62.12 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.231 0.613 . . . . 0.0 111.316 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 9.5 t -62.09 -36.41 81.62 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.751 0.657 . . . . 0.0 110.89 174.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 m -65.83 -39.06 90.46 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 110.819 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.26 86.39 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.601 0.76 . . . . 0.0 110.455 174.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.64 -34.2 77.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.742 0.817 . . . . 0.0 110.839 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 53' ' ' THR . 64.1 mmtt -76.53 -30.33 57.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.28 -41.61 98.42 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 114.062 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -65.66 -42.32 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 117.112 0.456 . . . . 0.0 111.035 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.11 -36.28 83.79 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.967 0.507 . . . . 0.0 110.74 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.3 m -71.66 -46.03 60.16 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.695 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 33.6 m -67.15 -28.97 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 118.204 0.456 . . . . 0.0 110.8 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -69.21 -38.47 78.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.342 0.657 . . . . 0.0 110.491 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.5 t -76.31 -36.83 58.12 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.855 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -93.0 8.44 39.89 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.18 0.992 . . . . 0.0 111.465 -176.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.489 ' OG ' ' HA ' ' A' ' 114' ' ' LYS . 16.9 t -62.33 -44.94 89.73 Favored Pre-proline 0 CA--C 1.571 1.762 0 C-N-CA 124.709 1.203 . . . . 0.0 112.222 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.81 -6.73 6.62 Favored 'Trans proline' 0 C--N 1.393 2.904 0 C-N-CA 121.845 1.696 . . . . 0.0 113.479 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -83.89 85.75 7.27 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.99 0.516 . . . . 0.0 110.112 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.33 -23.3 67.35 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.864 0.866 . . . . 0.0 112.593 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -66.79 -34.9 78.84 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.649 0.78 . . . . 0.0 111.189 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -76.36 -20.9 56.75 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.11 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -73.21 116.21 13.48 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -96.24 98.38 10.26 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 147.43 38.82 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.946 0.403 . . . . 0.0 110.139 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -144.62 167.96 21.29 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.916 1.287 . . . . 0.0 109.129 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.4 m -126.73 114.73 18.37 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.278 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.11 154.7 5.33 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.855 1.262 . . . . 0.0 111.221 172.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 p -68.92 -12.94 62.11 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.631 0.772 . . . . 0.0 112.266 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -79.74 1.83 25.14 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.55 0.74 . . . . 0.0 111.948 170.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.48 10.59 84.3 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.172 0.295 . . . . 0.0 112.874 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -88.35 141.33 28.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.609 0.764 . . . . 0.0 110.154 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -101.77 128.56 48.05 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.964 0.506 . . . . 0.0 110.119 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.612 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 30.0 p90 -142.75 175.52 9.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -133.96 158.79 42.59 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 122.966 0.506 . . . . 0.0 110.153 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -127.05 100.72 6.24 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.52 HD21 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.27 111.54 18.44 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 173.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.41 ' HE2' HG12 ' A' ' 93' ' ' ILE . 16.2 ptpt -127.93 155.37 44.32 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.558 0.343 . . . . 0.0 110.177 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.47 178.79 6.45 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.464 0.705 . . . . 0.0 110.692 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.28 -10.81 57.33 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.499 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.493 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 2.0 m-20 -80.86 5.4 16.17 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.295 1.038 . . . . 0.0 111.621 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 67.8 11.27 8.29 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.805 1.242 . . . . 0.0 111.976 -178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.493 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 4.0 pt20 -106.87 135.11 48.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.781 0.433 . . . . 0.0 110.955 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.41 HG12 ' HE2' ' A' ' 87' ' ' LYS . 55.9 mt -70.85 99.47 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 123.922 0.889 . . . . 0.0 110.131 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.52 HD11 HD21 ' A' ' 86' ' ' LEU . 18.3 pt -79.05 -12.91 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.313 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.44 146.54 9.58 Favored Glycine 0 C--O 1.215 -1.035 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.1 p -166.7 167.16 15.45 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 117.743 0.771 . . . . 0.0 109.772 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.2 t -113.75 165.25 12.74 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -76.78 -54.57 6.45 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.612 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 26.7 ptt? 174.33 131.52 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.75 1.62 . . . . 0.0 108.402 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.51 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 97.3 m-85 -98.28 156.87 16.51 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.072 0.549 . . . . 0.0 109.941 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.65 64.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.822 0.849 . . . . 0.0 111.213 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.5 p -130.39 177.1 7.59 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.54 0.736 . . . . 0.0 110.623 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.37 -28.56 65.21 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.845 172.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -61.82 -40.58 95.79 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.292 0.637 . . . . 0.0 110.572 172.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.51 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 14.6 m -68.55 -35.64 77.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.786 178.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -68.34 -46.14 70.99 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.969 0.508 . . . . 0.0 111.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.09 -28.59 65.53 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.779 0.432 . . . . 0.0 111.357 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 m -64.41 -40.58 96.06 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 168.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.68 99.63 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.785 175.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.9 mm -60.4 -48.88 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.714 0.805 . . . . 0.0 110.258 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.29 83.2 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.298 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.97 -37.55 61.9 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.695 -178.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.57 -30.69 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 123.288 0.635 . . . . 0.0 110.13 176.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.489 ' HA ' ' OG ' ' A' ' 66' ' ' SER . 37.9 ttpt -70.23 -45.1 67.2 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 120.929 0.395 . . . . 0.0 110.81 172.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.69 -28.74 66.1 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.847 0.859 . . . . 0.0 111.924 -177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.78 -10.23 14.79 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.654 0.781 . . . . 0.0 111.415 -174.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.1 -23.79 75.22 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 112.024 -0.431 . . . . 0.0 112.024 175.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 25.4 p -78.45 -0.52 29.64 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.285 1.034 . . . . 0.0 112.406 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.449 ' HA ' ' HE1' ' A' ' 17' ' ' MET . 29.6 t -70.85 135.69 48.23 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.482 0.713 . . . . 0.0 110.847 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -90.7 -16.48 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 110.335 175.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.5 m -73.98 93.16 2.19 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.752 0.821 . . . . 0.0 110.892 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.471 HG23 ' HE2' ' A' ' 33' ' ' PHE . 2.0 p -96.63 132.99 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.548 ' HZ2' ' HB3' ' A' ' 123' ' ' LYS . 8.3 mtpm? -126.23 106.6 9.65 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.899 0.88 . . . . 0.0 109.211 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.68 101.85 3.77 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.119 0.568 . . . . 0.0 110.86 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -76.26 -26.25 55.77 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 123.827 0.851 . . . . 0.0 109.977 169.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.52 HG23 ' HB3' ' A' ' 25' ' ' LYS . 31.3 p -62.42 143.25 57.28 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.323 1.049 . . . . 0.0 110.95 177.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.8 -10.33 18.59 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.825 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 34.3 p -90.69 159.48 16.35 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.318 1.047 . . . . 0.0 110.774 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 7.9 t30 . . . . . 0 C--O 1.248 1.001 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 174.943 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.604 0 N-CA-C 111.756 -0.538 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.8 m -87.37 160.9 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 123.808 0.843 . . . . 0.0 110.531 179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -64.83 154.43 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.716 0.807 . . . . 0.0 111.069 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -67.62 129.67 40.64 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.578 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.07 104.79 11.91 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -85.2 -168.84 45.24 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 116.001 -0.545 . . . . 0.0 113.257 -175.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 29.5 p90 -141.08 148.75 40.65 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 123.319 0.647 . . . . 0.0 110.368 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.431 ' HB3' ' HD1' ' A' ' 33' ' ' PHE . 85.6 m-85 -98.41 120.29 38.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.943 175.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.44 ' HG2' ' HD3' ' A' ' 123' ' ' LYS . 44.5 mt-10 -92.62 114.09 26.55 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 173.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 31' ' ' PHE . 52.4 tp -80.61 96.63 6.91 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 172.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.7 p -105.04 148.54 26.66 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.134 1.373 . . . . 0.0 109.826 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -102.1 160.25 14.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.51 0.724 . . . . 0.0 111.13 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 96.5 p -89.94 -175.46 4.6 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 166.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.3 p -64.03 -20.21 65.75 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.082 0.553 . . . . 0.0 111.338 172.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -103.01 17.67 23.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.279 1.032 . . . . 0.0 111.339 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 64.74 16.48 10.43 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.841 1.257 . . . . 0.0 112.683 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -72.96 138.51 46.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.074 0.549 . . . . 0.0 110.066 -179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.518 ' HB3' HD12 ' A' ' 23' ' ' LEU . 77.7 m-85 -89.43 133.95 34.31 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.129 0.972 . . . . 0.0 110.159 -166.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.505 ' HB2' HD13 ' A' ' 48' ' ' LEU . 24.4 ttp180 -148.75 120.72 8.21 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -172.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.431 ' HD1' ' HB3' ' A' ' 21' ' ' PHE . 23.5 m-85 -90.2 124.1 34.57 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.424 HG11 HG23 ' A' ' 45' ' ' THR . 35.4 m -111.18 131.71 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 21.7 tp -100.3 116.43 32.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 95.7 mttt -101.58 128.07 48.0 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 170.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.14 166.75 7.35 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.948 0.78 . . . . 0.0 111.349 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.57 -2.5 35.83 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-N 115.818 -0.628 . . . . 0.0 114.571 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -86.7 -14.0 43.78 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.505 0.722 . . . . 0.0 110.64 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.34 -5.64 41.55 Favored Glycine 0 C--N 1.351 1.405 0 C-N-CA 123.592 0.615 . . . . 0.0 113.758 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -97.46 139.86 32.76 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.295 0.638 . . . . 0.0 110.713 -176.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 20.5 m -67.41 143.81 56.1 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.044 0.938 . . . . 0.0 109.822 174.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -132.43 -20.5 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.961 0.905 . . . . 0.0 111.362 -176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -152.5 149.39 28.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.426 0.69 . . . . 0.0 109.498 -170.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.424 HG23 HG11 ' A' ' 34' ' ' VAL . 72.1 m -148.79 117.93 6.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.197 0.999 . . . . 0.0 109.273 177.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.8 t -79.33 172.49 13.72 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.391 0.676 . . . . 0.0 111.062 177.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.42 173.64 9.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.147 0.579 . . . . 0.0 111.649 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.4 mm? -82.83 111.36 18.66 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.476 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.6 m-85 -88.72 131.13 35.16 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.822 1.249 . . . . 0.0 109.164 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -66.49 -30.24 70.53 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.727 0.811 . . . . 0.0 111.414 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.6 m -125.52 143.97 50.76 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.709 0.804 . . . . 0.0 110.446 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.95 68.64 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.818 0.847 . . . . 0.0 111.017 175.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.5 p -62.05 -43.08 99.61 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.38 1.072 . . . . 0.0 110.793 176.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.476 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 8.3 m -65.52 -37.86 87.99 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.153 0.981 . . . . 0.0 110.073 178.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.9 -38.53 88.96 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.943 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.7 -39.66 94.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.08 0.552 . . . . 0.0 110.564 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.93 -37.52 86.26 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.575 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.4 76.36 Favored Glycine 0 C--N 1.35 1.334 0 O-C-N 123.878 0.736 . . . . 0.0 112.868 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.443 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.0 tt -72.04 -31.71 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 122.849 0.459 . . . . 0.0 111.118 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.42 87.24 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.99 0.516 . . . . 0.0 110.356 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.4 m -70.4 -52.14 24.51 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.955 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 59' ' ' ILE . 21.3 m -58.26 -33.05 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 122.585 0.354 . . . . 0.0 111.85 -173.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -66.99 -43.18 83.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.868 0.867 . . . . 0.0 110.799 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.6 t -69.59 -36.06 75.9 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.285 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.412 ' HB3' HD22 ' A' ' 86' ' ' LEU . 13.4 m120 -88.26 -0.42 57.1 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.027 0.931 . . . . 0.0 111.979 -174.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.626 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.5 m -55.03 -52.13 73.7 Favored Pre-proline 0 CA--C 1.565 1.534 0 C-N-CA 123.773 0.829 . . . . 0.0 112.425 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -81.26 -12.53 11.58 Favored 'Trans proline' 0 C--N 1.392 2.818 0 C-N-CA 121.914 1.743 . . . . 0.0 113.034 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -85.62 86.64 7.36 Favored 'General case' 0 C--N 1.351 0.646 0 C-N-CA 123.468 0.707 . . . . 0.0 109.979 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -62.54 -21.77 65.8 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.622 0.769 . . . . 0.0 111.459 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HG3' ' HE ' ' A' ' 71' ' ' ARG . 11.7 tp10 -52.8 -36.28 58.11 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.319 1.448 . . . . 0.0 111.634 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' HE ' ' HG3' ' A' ' 70' ' ' GLU . 5.1 mmp_? -90.27 0.77 57.07 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.58 0.752 . . . . 0.0 112.884 -174.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -99.48 134.13 42.8 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.911 0.484 . . . . 0.0 110.204 175.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 16.7 mm-40 -100.09 92.93 5.47 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.212 1.005 . . . . 0.0 108.363 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -89.1 101.36 14.02 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.745 0.783 . . . . 0.0 108.961 -176.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -136.16 173.22 11.95 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.698 0.799 . . . . 0.0 110.543 -170.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -120.98 128.01 52.32 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.744 0.817 . . . . 0.0 109.924 -176.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.0 160.43 32.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.726 0.811 . . . . 0.0 109.882 169.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.0 m -65.38 -10.96 37.7 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.196 0.598 . . . . 0.0 112.264 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -76.27 -5.18 45.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.038 0.935 . . . . 0.0 111.385 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.42 9.24 85.16 Favored Glycine 0 C--N 1.351 1.4 0 C-N-CA 123.306 0.479 . . . . 0.0 112.197 -174.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -97.22 132.81 42.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.242 0.617 . . . . 0.0 111.115 -173.313 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.639 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 62.4 m-85 -94.59 133.89 37.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.322 1.049 . . . . 0.0 110.597 -173.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -145.31 174.8 10.79 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.86 0.864 . . . . 0.0 109.245 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.471 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 24.9 p90 -138.69 134.26 33.39 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.277 0.631 . . . . 0.0 110.198 174.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.524 ' HB3' HD11 ' A' ' 93' ' ' ILE . 95.3 m-20 -110.04 120.6 42.96 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.574 0.75 . . . . 0.0 109.402 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.495 HD21 HD12 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.2 129.3 34.8 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -105.5 137.06 43.95 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.45 1.1 . . . . 0.0 110.448 -168.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.23 169.69 8.3 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.509 0.723 . . . . 0.0 110.082 173.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.59 -21.4 66.33 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.797 0.839 . . . . 0.0 111.904 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 11.5 m120 -85.79 4.67 35.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.811 0.844 . . . . 0.0 111.784 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.5 m170 70.73 -1.16 2.7 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.276 1.43 . . . . 0.0 112.82 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.41 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 30.0 pt20 -75.99 149.33 37.61 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 123.168 0.587 . . . . 0.0 110.467 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.524 HD11 ' HB3' ' A' ' 85' ' ' ASN . 41.4 mm -87.37 99.59 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.495 HD12 HD21 ' A' ' 86' ' ' LEU . 12.5 pt -79.14 -4.79 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.83 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.16 94.16 0.1 OUTLIER Glycine 0 C--N 1.342 0.871 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.6 p -88.52 125.87 34.98 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.3 t -79.27 169.99 17.29 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 121.675 0.75 . . . . 0.0 110.948 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -74.41 150.91 39.78 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.119 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 16.5 ptm -76.55 116.5 17.29 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.433 ' HB3' ' OG ' ' A' ' 105' ' ' SER . 62.9 m-85 -102.91 153.16 20.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.856 0.862 . . . . 0.0 111.291 -173.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.85 -52.39 11.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.036 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.2 p -104.18 163.87 12.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.093 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.01 -27.51 61.82 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.05 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.5 -42.13 95.7 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.445 0.698 . . . . 0.0 111.278 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 100' ' ' TYR . 34.5 p -73.29 -30.79 63.64 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.198 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.639 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 27.0 ptt180 -76.87 -36.3 56.86 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.07 0.395 . . . . 0.0 111.446 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.24 -29.87 60.35 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.884 0.373 . . . . 0.0 110.76 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.9 m -69.35 -33.88 73.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.53 167.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.22 -37.38 94.46 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.535 173.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.9 mm -59.82 -48.34 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 174.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.47 -36.23 79.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.361 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -71.25 -52.13 20.68 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.154 0.582 . . . . 0.0 110.831 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.72 -31.05 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.542 0.737 . . . . 0.0 110.928 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 27.6 ttpp -70.04 -39.47 75.73 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.627 0.771 . . . . 0.0 111.527 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.91 -47.7 43.53 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.495 0.718 . . . . 0.0 111.56 -178.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.06 -20.16 19.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -169.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -69.76 -27.01 73.76 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 123.322 0.389 . . . . 0.0 113.164 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.607 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 72.5 p -67.66 -30.35 69.87 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.646 0.778 . . . . 0.0 111.436 176.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.3 m -83.58 88.05 7.03 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.749 0.82 . . . . 0.0 109.89 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.87 62.53 5.71 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.54 0.686 . . . . 0.0 110.789 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.8 t -101.81 110.72 22.76 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 173.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.9 t -96.42 114.5 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.689 0.796 . . . . 0.0 110.846 -171.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.44 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 84.8 tttt -83.57 115.54 22.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.06 0.944 . . . . 0.0 108.483 166.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -73.86 131.69 41.75 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 0.0 110.287 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -138.91 -8.1 1.39 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.069 0.948 . . . . 0.0 110.395 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.1 p -71.84 91.51 1.17 Allowed 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.084 0.468 . . . . 0.0 110.211 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.43 -6.72 20.84 Favored Glycine 0 C--N 1.349 1.265 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.548 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.1 t -123.67 122.84 39.16 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.862 0.865 . . . . 0.0 109.665 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.563 1.452 0 C-N-CA 124.08 0.952 . . . . 0.0 112.39 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.414 0 N-CA-C 111.694 -0.562 . . . . 0.0 111.694 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.99 156.36 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.241 0.616 . . . . 0.0 110.408 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.7 pt -76.2 166.51 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.61 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 49.5 mtt -75.02 133.16 41.71 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.11 118.91 19.35 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.41 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . 63.33 -154.3 45.03 Favored Glycine 0 C--N 1.349 1.274 0 O-C-N 123.929 0.768 . . . . 0.0 113.657 178.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.4 p90 -162.75 165.87 24.98 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.753 0.821 . . . . 0.0 110.683 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 69.1 m-85 -105.44 157.58 17.25 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.534 1.134 . . . . 0.0 108.731 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.483 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 74.8 mt-10 -137.18 110.09 7.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 169.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.7 tp -92.82 106.14 18.15 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 m -129.35 152.0 49.38 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.54 ' HE3' ' HB ' ' A' ' 126' ' ' THR . 19.1 ptpt -106.51 148.59 28.03 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.038 0.446 . . . . 0.0 110.4 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -72.4 -178.03 2.4 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.345 1.058 . . . . 0.0 111.264 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.0 t -66.74 -29.74 69.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 122.875 0.47 . . . . 0.0 111.247 -178.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -86.52 15.15 5.78 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.026 0.53 . . . . 0.0 111.585 174.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 17.3 m120 68.68 14.03 8.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.912 1.285 . . . . 0.0 112.748 171.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.48 134.23 35.5 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.605 0.762 . . . . 0.0 109.272 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -86.97 140.52 29.5 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.544 0.738 . . . . 0.0 110.134 -169.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -152.72 115.7 4.6 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -93.35 138.2 31.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.528 HG11 HG22 ' A' ' 45' ' ' THR . 30.4 m -110.8 153.77 12.52 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 172.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.419 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -117.35 123.16 45.81 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.443 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -119.76 146.24 45.83 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 110.359 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.486 ' HA ' HD22 ' A' ' 116' ' ' ASN . . . -75.4 -178.71 4.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.77 0.828 . . . . 0.0 110.552 172.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -66.14 -17.98 66.47 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.562 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -88.33 -2.37 58.56 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.906 0.882 . . . . 0.0 112.192 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.37 2.82 88.98 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 113.989 0.355 . . . . 0.0 113.989 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -81.68 126.76 32.17 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.029 0.531 . . . . 0.0 110.095 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.1 m -70.09 120.63 16.08 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 pt -100.25 -26.49 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.965 1.306 . . . . 0.0 111.016 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.8 tp -151.54 120.93 6.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.368 0.667 . . . . 0.0 109.395 -174.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.528 HG22 HG11 ' A' ' 34' ' ' VAL . 59.4 m -119.63 122.07 40.71 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.417 0.687 . . . . 0.0 109.543 176.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.5 t -73.93 -176.28 2.43 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 122.764 0.426 . . . . 0.0 110.569 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -91.94 178.19 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.72 0.408 . . . . 0.0 110.469 172.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.6 mp -84.47 112.42 20.36 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -178.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -90.33 115.85 27.84 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.145 0.978 . . . . 0.0 108.569 170.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.4 p -69.97 -7.73 43.14 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.01 0.524 . . . . 0.0 111.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.9 m -119.33 135.31 54.78 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.546 1.138 . . . . 0.0 109.738 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -29.36 69.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.929 0.492 . . . . 0.0 110.655 174.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -63.98 -43.78 94.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.125 0.97 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.7 p -74.41 -28.27 61.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.176 0.59 . . . . 0.0 111.362 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.58 -36.01 82.5 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.95 0.5 . . . . 0.0 110.616 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -73.17 -37.19 66.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.578 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -61.07 -39.98 91.94 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.499 172.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.01 85.24 Favored Glycine 0 C--N 1.348 1.244 0 O-C-N 123.867 0.73 . . . . 0.0 113.226 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.2 tt -71.39 -32.0 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 CA-C-O 120.925 0.393 . . . . 0.0 111.0 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 -30.96 70.26 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.799 0.44 . . . . 0.0 110.557 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 m -74.06 -43.32 58.22 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.087 178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.27 -27.95 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 CA-C-N 118.276 0.489 . . . . 0.0 110.521 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.29 -44.32 79.53 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.648 0.779 . . . . 0.0 109.498 176.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -78.08 -26.64 48.26 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.0 0.52 . . . . 0.0 111.497 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -103.26 13.68 33.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.88 0.872 . . . . 0.0 111.381 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.422 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 57.4 p -66.92 -45.89 54.03 Favored Pre-proline 0 CA--C 1.565 1.537 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.828 173.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.29 -7.07 15.97 Favored 'Trans proline' 0 C--N 1.397 3.097 0 CA-C-N 121.873 1.705 . . . . 0.0 112.433 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -83.1 77.16 9.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.537 0.735 . . . . 0.0 110.373 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -60.6 -35.82 77.06 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.703 1.201 . . . . 0.0 112.362 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -74.87 -23.9 58.47 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.272 0.629 . . . . 0.0 110.969 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -77.19 -21.37 54.04 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 123.341 0.657 . . . . 0.0 110.649 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -73.87 104.61 4.81 Favored 'General case' 0 C--N 1.356 0.886 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 167.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -96.86 113.23 24.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.282 0.633 . . . . 0.0 109.292 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 147.05 34.03 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 173.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -147.58 135.59 21.28 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.278 1.031 . . . . 0.0 108.954 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.7 m -98.32 125.19 43.34 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.07 164.85 26.1 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.025 0.93 . . . . 0.0 110.893 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -69.17 -26.37 64.82 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.435 0.694 . . . . 0.0 110.341 178.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -76.35 -4.64 43.33 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.43 1.092 . . . . 0.0 111.244 174.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.44 10.07 74.53 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.868 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -81.44 122.46 27.54 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 122.993 0.517 . . . . 0.0 110.306 -177.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -88.36 126.79 35.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -147.57 175.34 10.93 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -127.0 161.59 28.01 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.381 0.672 . . . . 0.0 110.503 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -140.42 124.19 17.24 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.439 1.096 . . . . 0.0 108.404 176.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.0 tp -84.57 106.59 16.25 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 172.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.412 ' HE3' ' HA ' ' A' ' 91' ' ' HIS . 2.8 tmtm? -86.38 150.13 24.53 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.9 34.38 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.244 0.617 . . . . 0.0 110.365 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.53 -14.48 51.56 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.463 0.705 . . . . 0.0 111.931 177.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -85.94 14.82 5.57 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 0.0 111.475 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.412 ' HA ' ' HE3' ' A' ' 87' ' ' LYS . 71.8 m80 67.07 19.13 10.53 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.905 1.282 . . . . 0.0 112.164 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -109.76 147.45 33.2 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.682 0.793 . . . . 0.0 109.914 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.9 mm -90.12 105.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 170.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.7 pt -87.55 -7.87 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.16 145.71 9.08 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 123.407 0.442 . . . . 0.0 112.605 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -154.45 122.38 5.92 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.205 1.402 . . . . 0.0 108.917 174.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.8 p -67.89 153.74 43.07 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 172.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -60.59 -78.59 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.815 0.697 . . . . 0.0 111.169 -174.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.401 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 24.9 ptt? -173.28 121.97 0.37 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.389 1.076 . . . . 0.0 108.966 176.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -103.27 148.94 25.21 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.71 -37.53 35.47 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.636 174.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.6 p -114.45 147.76 38.81 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.357 0.663 . . . . 0.0 111.76 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.63 -22.45 64.41 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.535 176.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -58.82 -45.11 90.73 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.69 0.796 . . . . 0.0 111.164 173.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m -73.0 -23.99 60.7 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.363 0.665 . . . . 0.0 111.29 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.429 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.9 mtp180 -62.69 -51.11 68.48 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.663 0.385 . . . . 0.0 110.28 168.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -66.54 -34.61 78.29 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.943 0.897 . . . . 0.0 111.061 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.7 m -70.32 -34.68 72.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.929 0.492 . . . . 0.0 109.936 174.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.458 ' O ' HG21 ' A' ' 113' ' ' VAL . . . -61.14 -50.68 64.59 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.448 173.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 106' ' ' ARG . 40.7 mm -56.4 -45.28 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.244 1.018 . . . . 0.0 110.065 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.84 89.5 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.821 0.848 . . . . 0.0 110.849 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.5 t -73.16 -34.94 66.33 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.763 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.458 HG21 ' O ' ' A' ' 109' ' ' GLY . 75.4 t -69.31 -37.28 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.139 0.576 . . . . 0.0 110.943 -178.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HB2' ' HZ3' ' A' ' 114' ' ' LYS . 10.4 mtmp? -69.93 -37.81 76.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.726 0.41 . . . . 0.0 110.616 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.62 76.19 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.71 177.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.486 HD22 ' HA ' ' A' ' 37' ' ' ALA . 2.4 m-20 -85.25 -11.42 54.88 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.145 0.978 . . . . 0.0 111.588 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.07 -36.23 60.67 Favored Glycine 0 C--N 1.344 0.997 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.8 t -82.58 -2.29 53.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.321 0.648 . . . . 0.0 111.308 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.4 t -73.61 160.39 31.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.345 0.658 . . . . 0.0 110.318 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.91 2.8 3.15 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.224 0.61 . . . . 0.0 111.517 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.2 t -79.82 101.25 8.4 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.212 0.605 . . . . 0.0 110.019 178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 m -110.07 141.72 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.03 0.532 . . . . 0.0 109.795 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.483 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 96.6 mttt -106.66 101.48 10.93 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.63 107.07 13.13 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -113.88 15.31 18.6 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.153 0.981 . . . . 0.0 110.922 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.54 ' HB ' ' HE3' ' A' ' 25' ' ' LYS . 46.4 p -65.16 119.96 11.81 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.095 0.558 . . . . 0.0 111.56 -176.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 69.68 53.81 14.78 Favored Glycine 0 C--N 1.348 1.246 0 O-C-N 123.44 0.463 . . . . 0.0 113.508 171.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.1 t -75.8 84.69 2.77 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.252 1.187 0 C-N-CA 123.437 0.695 . . . . 0.0 110.111 -177.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -82.86 148.31 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.153 0.581 . . . . 0.0 110.431 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 pt -80.16 166.81 2.36 Favored 'Isoleucine or valine' 0 C--O 1.246 0.896 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 168.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 83.6 mtp -69.43 96.85 0.92 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.155 0.503 . . . . 0.0 109.717 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.18 74.01 9.65 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.745 0.783 . . . . 0.0 109.71 -177.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.29 142.38 3.89 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.646 -1.161 . . . . 0.0 111.771 -179.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.407 ' HA ' HG22 ' A' ' 121' ' ' THR . 43.5 p90 -157.58 155.3 29.93 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.881 0.872 . . . . 0.0 110.051 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.424 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 73.3 m-85 -98.72 140.83 32.34 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.881 0.873 . . . . 0.0 108.772 174.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 37.3 mt-10 -126.35 111.09 14.1 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 170.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 21.3 tp -92.67 100.22 12.77 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.445 0.698 . . . . 0.0 109.216 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.4 t -116.34 152.61 33.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.87 0.868 . . . . 0.0 109.1 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -95.4 158.09 15.61 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 74.0 p -92.74 173.83 7.57 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.339 0.655 . . . . 0.0 110.381 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 t -69.07 -19.78 64.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.229 0.612 . . . . 0.0 109.87 170.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -87.86 9.31 22.37 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.75 0.82 . . . . 0.0 110.36 172.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 79.77 -22.07 0.3 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 125.254 1.422 . . . . 0.0 113.129 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -68.87 136.06 52.06 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.554 0.741 . . . . 0.0 111.222 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -92.38 131.07 37.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.932 0.893 . . . . 0.0 109.704 -170.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -147.17 121.63 9.7 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.598 0.759 . . . . 0.0 109.549 -173.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -93.07 141.97 27.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.522 HG11 HG23 ' A' ' 45' ' ' THR . 27.6 m -117.45 136.09 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.366 1.066 . . . . 0.0 109.677 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.424 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -91.83 115.61 28.2 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -109.72 123.92 50.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.155 0.982 . . . . 0.0 108.673 174.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.66 170.73 4.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.91 0.484 . . . . 0.0 110.959 172.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.4 -10.13 46.91 Favored Glycine 0 N--CA 1.477 1.415 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.23 -8.34 58.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.614 1.166 . . . . 0.0 110.876 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.06 10.88 84.36 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.883 -176.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -101.85 132.36 47.67 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.13 0.972 . . . . 0.0 109.813 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.0 m -70.17 118.32 12.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 pt -99.78 -16.43 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.167 0.987 . . . . 0.0 110.964 -178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.9 tp -154.65 139.1 16.8 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.522 HG23 HG11 ' A' ' 34' ' ' VAL . 40.4 m -135.29 123.44 22.94 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.8 t -79.98 177.68 8.76 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.46 0.704 . . . . 0.0 111.755 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -72.36 166.68 22.04 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.236 0.614 . . . . 0.0 111.812 172.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.01 113.21 18.0 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 171.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -93.66 138.73 31.58 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.423 0.689 . . . . 0.0 109.947 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t -74.69 -13.78 60.66 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.441 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.8 m -139.31 148.79 43.43 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.832 0.853 . . . . 0.0 110.143 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.8 tmmm? -64.63 -38.72 91.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.285 1.034 . . . . 0.0 108.678 176.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -62.85 -34.46 77.39 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.544 0.738 . . . . 0.0 111.741 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.0 m -64.83 -32.76 74.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.22 0.608 . . . . 0.0 111.158 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.12 -29.29 62.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.135 0.574 . . . . 0.0 111.314 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 -37.86 74.94 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.353 0.661 . . . . 0.0 110.077 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.603 ' HZ1' ' HB3' ' A' ' 57' ' ' LYS . 8.0 mtpm? -66.39 -35.01 79.24 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.956 171.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.97 91.66 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.586 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.513 ' HA ' HG21 ' A' ' 62' ' ' VAL . 10.7 tt -68.16 -36.45 75.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.034 0 CA-C-N 116.952 0.376 . . . . 0.0 110.368 177.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.11 -36.03 72.3 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.012 0.525 . . . . 0.0 110.736 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.0 m -73.64 -47.82 37.13 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.43 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.513 HG21 ' HA ' ' A' ' 59' ' ' ILE . 11.1 m -66.42 -28.71 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-N 117.708 0.231 . . . . 0.0 110.854 -178.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.603 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 78.7 ttt-85 -78.22 -39.07 41.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.351 1.06 . . . . 0.0 110.684 -176.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.1 t -70.21 -35.09 73.67 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.3 175.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -97.62 4.59 50.13 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.812 0.845 . . . . 0.0 111.272 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -66.25 -46.52 61.41 Favored Pre-proline 0 CA--C 1.562 1.407 0 C-N-CA 123.904 0.882 . . . . 0.0 111.668 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.63 -18.68 32.73 Favored 'Trans proline' 0 C--N 1.393 2.914 0 C-N-CA 121.761 1.64 . . . . 0.0 112.818 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -95.72 97.23 9.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.957 0.503 . . . . 0.0 110.762 -172.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -21.61 66.71 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.209 0.603 . . . . 0.0 111.721 175.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.38 -33.65 21.35 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.783 1.633 . . . . 0.0 111.775 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -96.03 16.63 17.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.931 0.892 . . . . 0.0 112.069 -172.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -111.01 131.75 54.79 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 6.4 mm-40 -96.21 97.89 9.88 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.979 0.912 . . . . 0.0 109.196 -176.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.405 ' O ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.78 105.41 2.75 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.901 0.751 . . . . 0.0 109.915 179.167 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -136.56 160.99 37.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.498 0.719 . . . . 0.0 110.324 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.0 m -127.57 116.48 20.41 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.725 176.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.52 153.23 13.28 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 110.858 170.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -61.65 -15.26 38.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.839 0.856 . . . . 0.0 112.452 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -86.61 11.72 12.19 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.879 0.871 . . . . 0.0 111.618 178.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.28 24.84 74.54 Favored Glycine 0 C--N 1.352 1.437 0 O-C-N 123.105 0.253 . . . . 0.0 112.738 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -109.4 123.12 48.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.351 0.66 . . . . 0.0 110.219 -175.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -79.68 135.38 36.53 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.495 0.718 . . . . 0.0 109.905 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -151.47 140.07 20.67 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 4.0 m-85 -109.52 133.22 53.35 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.441 HD21 HD13 ' A' ' 93' ' ' ILE . 9.6 m-20 -105.63 125.38 50.91 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.442 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.86 122.36 28.13 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -86.24 138.23 32.02 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.438 1.095 . . . . 0.0 109.644 -175.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.515 ' HB3' HG21 ' A' ' 94' ' ' ILE . . . -95.15 168.25 10.87 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.904 0.882 . . . . 0.0 110.37 175.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.15 -19.48 62.42 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.233 0.613 . . . . 0.0 111.051 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.445 ' HB3' ' HG2' ' A' ' 92' ' ' GLN . 62.1 t30 -82.72 0.85 41.56 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.891 0.877 . . . . 0.0 111.543 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 69.43 18.08 7.95 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.688 1.195 . . . . 0.0 111.62 -176.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.445 ' HG2' ' HB3' ' A' ' 90' ' ' ASN . 4.2 pt20 -100.87 -170.49 1.85 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.634 0.774 . . . . 0.0 109.236 173.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.441 HD13 HD21 ' A' ' 85' ' ' ASN . 59.3 mt -106.63 148.01 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 175.359 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.515 HG21 ' HB3' ' A' ' 88' ' ' ALA . 5.6 pt -126.83 -1.15 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.25 1.02 . . . . 0.0 111.058 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 176.78 104.2 0.18 Allowed Glycine 0 C--N 1.35 1.361 0 N-CA-C 114.118 0.407 . . . . 0.0 114.118 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 m -88.83 125.87 35.1 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 98.6 p -75.81 167.37 22.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 120.76 0.314 . . . . 0.0 111.088 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -60.94 157.31 15.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.699 0.8 . . . . 0.0 110.613 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -78.7 119.43 21.92 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 121.17 0.509 . . . . 0.0 109.892 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -98.47 120.11 38.32 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.97 0.908 . . . . 0.0 109.543 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.09 -35.29 71.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.992 0.517 . . . . 0.0 110.774 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 m -100.25 154.47 18.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.286 0.634 . . . . 0.0 110.413 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.457 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -84.44 -24.75 29.4 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.768 0.827 . . . . 0.0 111.851 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -79.8 -32.15 40.76 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 173.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -29.77 69.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.961 0.505 . . . . 0.0 111.698 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.8 ptt180 -65.98 -33.54 76.05 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.502 177.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -69.04 -42.44 76.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.202 0.601 . . . . 0.0 110.095 -179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.4 m -69.64 -41.96 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.519 0.728 . . . . 0.0 111.062 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -68.71 -38.1 85.32 Favored Glycine 0 C--N 1.342 0.901 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.933 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.464 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 35.5 mm -76.77 -38.82 30.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.711 0.405 . . . . 0.0 110.206 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.44 -26.83 68.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.619 0.368 . . . . 0.0 110.757 173.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.5 t -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 92.6 t -59.28 -37.21 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.564 0.746 . . . . 0.0 110.796 175.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 110' ' ' ILE . 7.5 mtpm? -71.27 -33.1 69.47 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.545 0.738 . . . . 0.0 111.026 177.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.42 -51.71 14.17 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.626 0.771 . . . . 0.0 112.558 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -103.77 -4.15 24.02 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.819 0.847 . . . . 0.0 112.267 -173.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.74 -20.52 78.69 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.723 -0.217 . . . . 0.0 113.056 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.603 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 13.8 t -81.24 3.58 23.36 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.599 0.759 . . . . 0.0 111.596 176.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.0 t -89.93 169.3 11.34 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.766 0.426 . . . . 0.0 110.696 178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -123.35 11.09 9.3 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.797 0.839 . . . . 0.0 111.3 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.407 HG22 ' HA ' ' A' ' 20' ' ' TRP . 6.2 t -74.46 80.94 1.93 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-O 121.739 0.781 . . . . 0.0 111.53 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 27.7 m -97.49 124.69 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.357 0.663 . . . . 0.0 110.499 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.424 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 3.7 mptp? -96.29 82.12 3.39 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 171.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 7.1 p-10 -72.56 96.77 2.01 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.021 0.915 . . . . 0.0 109.025 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -93.42 8.8 39.12 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.783 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 42.6 p -63.74 109.41 1.7 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.411 1.084 . . . . 0.0 110.095 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.39 26.72 35.2 Favored Glycine 0 C--N 1.343 0.935 0 CA-C-N 116.633 -0.258 . . . . 0.0 112.562 -174.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.9 t -151.83 154.78 36.86 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.226 1.01 . . . . 0.0 108.982 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.989 179.841 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 112.401 -0.279 . . . . 0.0 112.401 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.7 m -87.29 132.48 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 120.883 0.373 . . . . 0.0 110.212 176.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.5 pt -88.97 170.71 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.283 0.633 . . . . 0.0 110.508 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 61.6 mtt -110.54 109.33 19.61 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.345 0.658 . . . . 0.0 110.097 -178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.84 73.33 10.38 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.89 134.59 3.75 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.462 -176.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.437 ' HA ' HG22 ' A' ' 121' ' ' THR . 48.5 p90 -161.35 153.16 19.38 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.608 0.763 . . . . 0.0 110.786 -173.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.472 ' HB2' HG21 ' A' ' 122' ' ' VAL . 97.5 m-85 -88.51 156.74 18.92 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.463 0.705 . . . . 0.0 109.391 169.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -138.58 107.67 6.04 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' A' ' 33' ' ' PHE . 37.7 tp -95.46 101.12 12.81 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.344 0.658 . . . . 0.0 109.571 -177.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.3 t -116.84 -177.74 3.27 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 123.629 0.771 . . . . 0.0 109.022 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -141.39 161.27 38.31 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -82.95 177.36 8.66 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.18 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.8 m -70.64 -22.36 62.52 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.132 0.573 . . . . 0.0 110.184 172.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.28 -5.22 48.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.841 0.856 . . . . 0.0 111.851 171.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 69.78 27.15 4.67 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.984 1.314 . . . . 0.0 111.698 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -87.15 119.66 27.61 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -88.61 142.26 27.84 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.74 0.816 . . . . 0.0 109.314 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HD2' HD22 ' A' ' 48' ' ' LEU . 58.8 ttt180 -157.43 117.37 3.41 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 -171.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 23' ' ' LEU . 46.9 p90 -98.82 133.06 43.67 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG13 HG22 ' A' ' 45' ' ' THR . 17.7 m -107.78 130.76 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.687 0.795 . . . . 0.0 109.05 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.4 tp -100.67 117.57 35.06 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -120.37 142.01 49.56 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.591 1.157 . . . . 0.0 109.516 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.34 -175.92 0.87 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.067 0.947 . . . . 0.0 111.677 173.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.98 -21.76 63.94 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 -176.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -84.34 -4.3 58.79 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.644 0.777 . . . . 0.0 112.533 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.84 8.4 87.71 Favored Glycine 0 C--N 1.343 0.943 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -82.42 132.15 35.21 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.729 0.812 . . . . 0.0 109.423 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.3 m -64.97 123.76 20.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.358 0.663 . . . . 0.0 112.007 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.5 HD13 ' HG ' ' A' ' 35' ' ' LEU . 29.9 pt -105.85 -14.45 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.141 0.976 . . . . 0.0 110.401 172.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 11.6 tp -165.59 144.49 6.26 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.795 0.838 . . . . 0.0 109.002 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.421 HG22 HG13 ' A' ' 34' ' ' VAL . 26.9 m -152.19 114.01 4.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.956 0.903 . . . . 0.0 109.221 176.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.408 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 5.3 m -64.26 170.17 3.99 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.212 1.005 . . . . 0.0 112.014 -177.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.65 174.63 11.39 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.888 0.375 . . . . 0.0 110.21 175.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.416 HD22 ' HD2' ' A' ' 32' ' ' ARG . 66.6 mt -71.71 113.66 8.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.183 0.593 . . . . 0.0 109.748 177.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -90.02 137.4 32.37 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.393 0.677 . . . . 0.0 109.998 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.9 t -69.16 -21.49 63.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.225 0.61 . . . . 0.0 111.624 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p -149.68 156.7 42.32 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.777 0.831 . . . . 0.0 110.371 -174.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -66.94 -28.82 68.6 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 177.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.9 p -59.0 -39.86 83.1 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 123.982 0.801 . . . . 0.0 110.79 176.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.9 m -71.85 -30.05 65.04 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.715 0.806 . . . . 0.0 111.383 177.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.67 -39.06 64.7 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.216 0.606 . . . . 0.0 110.986 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.73 -34.96 72.43 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.881 0.872 . . . . 0.0 110.058 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -62.07 -44.0 97.62 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.367 1.067 . . . . 0.0 109.74 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.84 -49.37 78.67 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.227 0.955 . . . . 0.0 113.042 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.547 ' HA ' HG21 ' A' ' 62' ' ' VAL . 14.9 tt -72.78 -33.83 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 122.297 0.239 . . . . 0.0 111.364 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.8 -32.07 73.39 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.901 0.48 . . . . 0.0 110.934 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.5 m -75.92 -45.45 35.1 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.509 176.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.547 HG21 ' HA ' ' A' ' 59' ' ' ILE . 24.1 m -66.66 -36.62 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 118.005 0.366 . . . . 0.0 111.185 -175.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.09 73.53 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.337 0.589 . . . . 0.0 110.142 -177.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.6 t -77.33 -32.7 55.39 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.973 0.909 . . . . 0.0 110.372 177.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.57 10.7 40.88 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.698 0.799 . . . . 0.0 111.385 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.552 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.6 m -58.76 -46.82 99.54 Favored Pre-proline 0 N--CA 1.484 1.251 0 C-N-CA 123.391 0.676 . . . . 0.0 112.618 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.18 -13.07 15.63 Favored 'Trans proline' 0 C--N 1.391 2.782 0 C-N-CA 121.559 1.506 . . . . 0.0 113.124 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -82.71 77.64 9.43 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -178.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.418 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 0.4 OUTLIER -64.45 -20.66 66.31 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.979 -177.861 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -67.05 -37.89 84.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.767 0.827 . . . . 0.0 110.923 174.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -71.01 -23.61 62.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.273 0.629 . . . . 0.0 111.679 178.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 67.8 m-85 -71.63 115.33 10.69 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 164.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.468 ' HB3' HD21 ' A' ' 85' ' ' ASN . 36.8 tt0 -97.23 117.76 32.16 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.097 0.959 . . . . 0.0 108.865 -173.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.532 ' H ' ' HD2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.72 105.36 4.99 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 110.633 -174.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -100.18 115.32 29.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.325 1.05 . . . . 0.0 109.52 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.0 m -112.75 111.44 22.23 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.44 ' HB2' ' HB2' ' A' ' 81' ' ' LYS . . . -69.37 153.04 44.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.393 173.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 p -61.82 -21.29 64.5 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.826 0.85 . . . . 0.0 111.573 175.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -84.03 11.51 7.8 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.821 0.848 . . . . 0.0 111.493 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.48 17.25 77.71 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 113.236 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.545 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 75.5 mmtt -84.25 123.12 29.8 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -102.8 124.14 47.77 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.466 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 8.1 p90 -152.81 177.94 10.18 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.955 1.302 . . . . 0.0 108.467 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.56 157.41 44.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.507 0.323 . . . . 0.0 111.329 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.468 HD21 ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -135.61 129.97 33.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.112 0.565 . . . . 0.0 110.183 168.033 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.758 HD22 HD13 ' A' ' 94' ' ' ILE . 1.6 tt -81.07 115.23 20.41 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -94.11 137.59 33.13 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.805 0.842 . . . . 0.0 109.794 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -93.95 175.85 6.56 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.004 0.922 . . . . 0.0 110.74 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.73 -23.41 66.74 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.77 0.828 . . . . 0.0 111.474 175.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -84.57 5.24 28.53 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.216 1.007 . . . . 0.0 111.566 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 66.95 10.46 7.67 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.087 1.355 . . . . 0.0 112.238 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.17 148.64 23.54 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.094 0.557 . . . . 0.0 110.558 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.501 HG22 ' HB2' ' A' ' 96' ' ' SER . 54.9 mt -78.22 99.99 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 170.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.758 HD13 HD22 ' A' ' 86' ' ' LEU . 14.3 pt -81.26 -6.75 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.222 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.408 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -179.58 121.31 0.73 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-O 119.345 -0.697 . . . . 0.0 111.812 173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.501 ' HB2' HG22 ' A' ' 93' ' ' ILE . 23.1 t -119.31 113.71 21.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.858 0.863 . . . . 0.0 110.468 177.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 44' ' ' LEU . 32.5 t -65.29 161.14 20.11 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.762 0.825 . . . . 0.0 111.372 174.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -88.95 163.46 15.56 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.296 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.545 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 17.6 ptt? -73.14 120.68 19.09 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.388 0.675 . . . . 0.0 111.668 -173.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -101.11 157.12 17.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.208 173.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.46 -46.0 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.837 0.455 . . . . 0.0 111.277 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.5 p -101.45 153.74 19.43 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 123.27 0.628 . . . . 0.0 110.88 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.41 82.44 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.888 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -59.56 -29.94 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.417 0.687 . . . . 0.0 112.763 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.2 m -71.56 -40.48 69.95 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 112.073 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.444 ' O ' HG12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -76.21 -26.83 56.51 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.395 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -65.89 -43.13 89.14 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 122.983 0.513 . . . . 0.0 110.138 172.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.7 m -63.6 -33.9 76.63 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.897 171.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.34 -40.0 98.44 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.944 0.777 . . . . 0.0 113.247 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 106' ' ' ARG . 44.5 mm -60.04 -46.22 94.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-O 121.213 0.53 . . . . 0.0 109.741 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.92 78.9 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.52 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.4 t -71.8 -43.27 65.95 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.147 0.579 . . . . 0.0 110.455 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.3 t -73.56 -24.72 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.43 0.692 . . . . 0.0 110.56 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.552 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.7 OUTLIER -62.47 -45.88 91.04 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 172.682 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.41 -50.15 16.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.998 -175.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -84.17 -26.9 28.45 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.154 0.982 . . . . 0.0 111.178 -172.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.439 ' HA2' ' HZ ' ' A' ' 21' ' ' PHE . . . -65.41 -43.2 95.31 Favored Glycine 0 C--N 1.346 1.114 0 O-C-N 123.613 0.571 . . . . 0.0 112.797 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 46.6 p -68.56 -27.7 66.31 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.586 0.754 . . . . 0.0 111.76 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -75.28 121.81 22.75 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.425 0.69 . . . . 0.0 110.15 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.04 43.34 1.14 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.368 1.067 . . . . 0.0 111.159 -174.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.437 HG22 ' HA ' ' A' ' 20' ' ' TRP . 2.6 t -95.36 111.93 23.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.108 0.963 . . . . 0.0 108.847 176.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 21' ' ' PHE . 27.0 t -134.73 135.33 53.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.245 0.618 . . . . 0.0 110.044 -174.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -91.38 95.31 9.92 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 166.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -75.12 95.03 3.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.689 0.757 . . . . 0.0 109.292 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -107.31 27.35 9.17 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.581 -1.191 . . . . 0.0 110.393 -178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 45.3 p -70.63 87.46 0.67 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.669 0.788 . . . . 0.0 110.814 -177.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.3 -2.9 79.13 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.153 -0.931 . . . . 0.0 113.491 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 50.6 m -77.96 97.88 5.48 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.157 0.583 . . . . 0.0 109.916 177.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 . . . . . 0 C--O 1.245 0.837 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.409 0 N-CA-C 112.216 -0.354 . . . . 0.0 112.216 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.6 m -78.84 140.67 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.508 0.723 . . . . 0.0 110.343 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 pp -82.44 130.16 36.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 122.792 0.437 . . . . 0.0 109.869 176.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 91.7 mmm -90.24 110.85 21.88 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.42 73.79 8.45 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.57 139.25 2.65 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.033 -176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -146.1 157.38 43.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.167 0.987 . . . . 0.0 109.581 -177.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -99.5 151.31 21.28 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.468 0.707 . . . . 0.0 110.015 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.456 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 48.3 mt-10 -137.29 115.05 11.33 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.431 1.092 . . . . 0.0 108.5 171.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.6 tp -80.45 98.41 7.52 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.3 p -94.09 155.06 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.343 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 12.5 ptmm? -113.65 165.81 12.16 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.495 0.718 . . . . 0.0 109.285 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -102.27 -178.94 3.84 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.055 0.542 . . . . 0.0 109.955 174.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.4 t -65.9 -27.21 68.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.032 0.533 . . . . 0.0 110.351 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.24 2.87 22.75 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.78 0.832 . . . . 0.0 111.728 174.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.412 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 12.3 t30 70.35 9.64 7.03 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.876 1.27 . . . . 0.0 111.477 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -74.63 131.48 40.95 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.153 0.581 . . . . 0.0 109.997 -177.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -92.58 137.63 32.2 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.03 0.932 . . . . 0.0 110.384 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -155.65 141.6 18.18 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -103.24 136.82 42.3 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.7 m -107.36 132.82 53.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 175.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.488 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.7 tp -100.22 114.98 28.82 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 171.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.54 141.61 35.71 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.395 1.078 . . . . 0.0 108.897 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.27 175.46 10.63 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.038 0.535 . . . . 0.0 110.201 171.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.94 -7.45 56.09 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 113.914 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -73.17 -18.37 61.28 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.001 0.92 . . . . 0.0 111.053 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.61 -7.51 74.47 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.413 -173.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -88.48 136.91 32.76 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.095 0.958 . . . . 0.0 110.176 -177.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.7 m -75.78 121.41 22.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.014 0.526 . . . . 0.0 109.786 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.39 -25.14 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.898 0.879 . . . . 0.0 110.839 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.488 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.0 tp -148.01 143.6 27.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.218 0.607 . . . . 0.0 109.963 -171.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 87.8 m -149.81 129.93 13.58 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.197 0.999 . . . . 0.0 108.806 175.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.4 p -78.6 170.85 16.0 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.134 0.573 . . . . 0.0 111.024 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HB3' ' HB ' ' A' ' 93' ' ' ILE . 7.9 pt-20 -70.17 170.15 12.17 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.078 0.551 . . . . 0.0 111.049 175.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.25 112.12 13.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -92.79 142.06 27.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.061 0.945 . . . . 0.0 109.761 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.7 p -72.51 -25.93 61.58 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.295 0.638 . . . . 0.0 111.022 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.5 m -124.42 138.43 54.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.926 0.89 . . . . 0.0 110.153 -175.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -67.47 -28.12 67.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.858 0.463 . . . . 0.0 110.475 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.5 p -57.67 -40.77 80.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.161 0.984 . . . . 0.0 110.985 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -65.93 -35.14 79.78 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.917 0.887 . . . . 0.0 111.127 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.3 -33.15 61.17 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.44 0.696 . . . . 0.0 111.411 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -69.86 -43.54 71.66 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.631 0.773 . . . . 0.0 110.195 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.13 -22.45 52.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.58 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.18 75.69 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.708 0.63 . . . . 0.0 112.622 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.449 ' HA ' HG21 ' A' ' 62' ' ' VAL . 6.1 tt -67.48 -33.07 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 122.699 0.4 . . . . 0.0 110.795 176.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.81 82.32 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.107 0.479 . . . . 0.0 110.346 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -76.09 -39.64 54.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.355 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.449 HG21 ' HA ' ' A' ' 59' ' ' ILE . 19.9 m -64.59 -33.11 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 CA-C-N 119.204 0.911 . . . . 0.0 110.495 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -70.6 -39.4 73.81 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 124.265 0.978 . . . . 0.0 110.624 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.8 t -74.14 -30.72 62.43 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.539 0.736 . . . . 0.0 110.841 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -107.55 18.35 21.59 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.786 0.835 . . . . 0.0 111.256 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.605 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 55.5 m -59.81 -49.63 90.66 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 123.398 0.679 . . . . 0.0 111.762 168.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.66 -4.65 12.97 Favored 'Trans proline' 0 C--N 1.398 3.165 0 C-N-CA 121.968 1.779 . . . . 0.0 113.098 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -92.67 81.7 4.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.965 0.506 . . . . 0.0 110.126 -173.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.55 -29.99 59.97 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 124.52 1.128 . . . . 0.0 112.265 176.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -63.26 -35.39 80.2 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.164 1.386 . . . . 0.0 110.514 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -76.14 -23.11 54.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.609 0.764 . . . . 0.0 112.117 -176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -73.91 138.63 44.4 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.442 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 73.3 mm-40 -98.97 95.34 7.08 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.7 103.68 15.38 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 56.7 mttm -124.5 157.3 35.62 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 109.348 -175.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.5 m -127.23 115.54 19.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.644 0.778 . . . . 0.0 109.563 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.23 159.7 5.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.162 0.985 . . . . 0.0 111.83 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.6 p -57.69 -27.0 62.51 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.328 1.051 . . . . 0.0 112.806 -174.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -88.83 16.53 6.71 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 112.109 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.77 31.83 62.03 Favored Glycine 0 C--N 1.35 1.339 0 CA-C-N 116.372 -0.376 . . . . 0.0 113.335 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.7 mmtt -101.41 122.1 43.14 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.082 0.553 . . . . 0.0 109.848 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -95.2 130.86 41.76 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.484 0.714 . . . . 0.0 109.491 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.455 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 45.6 p90 -149.37 161.44 42.06 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.302 0.641 . . . . 0.0 109.616 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.42 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 42.2 p90 -130.91 135.9 48.1 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.206 0.602 . . . . 0.0 109.865 176.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.64 117.21 31.65 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 172.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.578 HD22 HD11 ' A' ' 94' ' ' ILE . 0.8 OUTLIER -76.68 109.38 10.4 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.337 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -90.22 137.67 32.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.857 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -100.01 154.69 18.19 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.522 0.729 . . . . 0.0 109.19 169.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.03 -16.44 61.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -74.8 1.85 11.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.474 1.11 . . . . 0.0 111.993 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.0 m170 68.6 14.71 9.08 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.238 1.415 . . . . 0.0 111.428 -177.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -103.86 140.86 37.09 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.308 0.643 . . . . 0.0 109.632 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.412 ' HB ' ' HB3' ' A' ' 47' ' ' GLU . 51.2 mm -80.13 98.39 3.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.996 0.919 . . . . 0.0 108.877 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.578 HD11 HD22 ' A' ' 86' ' ' LEU . 24.7 pt -81.99 -12.9 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.511 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.69 142.17 8.51 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 t -153.55 165.29 36.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.645 0.778 . . . . 0.0 109.63 175.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 t -143.7 148.76 36.2 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.4 ' NE2' ' HG2' ' A' ' 99' ' ' MET . 0.0 OUTLIER -68.93 -42.61 76.54 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.715 0.635 . . . . 0.0 110.483 -175.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.461 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 27.7 ptt? 176.24 155.08 0.21 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.425 1.49 . . . . 0.0 108.632 171.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -103.59 128.68 50.82 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 165.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.58 98.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.914 0.886 . . . . 0.0 111.587 -173.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 p -111.81 146.59 37.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.097 0.959 . . . . 0.0 110.425 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -75.33 -16.66 60.39 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.637 0.775 . . . . 0.0 111.797 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.66 -33.37 62.49 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.399 0.68 . . . . 0.0 110.384 173.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.1 t -67.88 -20.08 65.09 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 17.2 ptt180 -55.99 -37.85 69.67 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 122.915 0.486 . . . . 0.0 110.97 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.18 -39.31 71.93 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.339 1.056 . . . . 0.0 110.127 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.82 -40.12 96.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.142 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.73 -47.04 70.05 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.888 -178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 43.1 mm -59.38 -45.16 93.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 122.785 0.434 . . . . 0.0 109.963 176.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.35 86.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.579 0.751 . . . . 0.0 111.423 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.2 t -76.05 -38.27 57.33 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.163 0.585 . . . . 0.0 111.058 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.32 -34.58 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.384 0.673 . . . . 0.0 110.538 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.605 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.9 OUTLIER -69.17 -48.66 61.62 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.48 0.712 . . . . 0.0 109.963 178.551 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.425 ' O ' HG21 ' A' ' 118' ' ' THR . . . -70.26 -51.28 31.81 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.142 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -83.53 0.21 47.51 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.453 0.701 . . . . 0.0 111.96 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.94 -30.97 72.23 Favored Glycine 0 C--N 1.347 1.147 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.425 HG21 ' O ' ' A' ' 115' ' ' ALA . 11.5 t -85.23 0.78 50.78 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.786 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.1 m -67.15 108.87 2.83 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 122.905 0.482 . . . . 0.0 110.214 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -73.33 -14.61 61.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.746 0.418 . . . . 0.0 111.462 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.4 t -66.04 103.55 0.97 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.571 0.748 . . . . 0.0 110.282 176.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.51 122.37 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 123.867 0.867 . . . . 0.0 110.064 177.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.456 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 22.1 mtpp -83.05 148.36 27.59 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.078 173.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -106.24 94.83 5.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -81.89 -10.98 59.13 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.841 0.856 . . . . 0.0 111.152 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.421 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 37.8 p -63.51 89.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.363 1.065 . . . . 0.0 112.261 -174.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.38 39.0 32.08 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.72 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.0 t -151.38 151.38 31.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.245 0.618 . . . . 0.0 110.252 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 7.1 t30 . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.085 0.954 . . . . 0.0 109.316 -179.55 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.738 0 N-CA-C 113.265 0.066 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.1 p90 -160.03 150.13 18.39 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.195 0.522 . . . . 0.0 111.027 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -94.32 149.35 21.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.178 0.991 . . . . 0.0 108.598 170.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.6 mt-10 -131.37 109.5 10.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 171.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.5 tp -87.16 107.98 18.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.5 t -122.62 142.96 50.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.935 0.894 . . . . 0.0 109.045 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -94.7 139.65 30.95 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 171.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.0 m -76.38 -175.54 3.29 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 0.0 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.6 t -61.16 -25.78 67.25 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.062 0.545 . . . . 0.0 111.181 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -95.63 16.16 18.01 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.053 0.941 . . . . 0.0 110.787 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 64.06 17.62 10.73 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.261 1.424 . . . . 0.0 112.992 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 86.5 mm-40 -82.5 127.49 33.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.529 0.731 . . . . 0.0 110.724 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -85.89 122.11 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.836 0.854 . . . . 0.0 109.076 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -147.39 120.39 8.79 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 124.171 0.989 . . . . 0.0 108.556 -172.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -99.18 137.9 37.04 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.3 m -107.53 131.72 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.6 tp -91.36 123.49 34.82 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -115.7 149.76 37.89 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 109.172 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.54 -173.75 4.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.313 1.045 . . . . 0.0 110.275 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -57.34 -34.6 68.38 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 114.509 0.564 . . . . 0.0 114.509 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -88.66 8.1 30.26 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.623 0.769 . . . . 0.0 112.005 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 6.43 89.3 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.797 -0.183 . . . . 0.0 113.302 -176.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.85 110.06 4.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 110.424 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -65.08 121.37 14.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 pt -114.38 -20.78 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.61 1.164 . . . . 0.0 110.897 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -147.81 146.52 29.17 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.9 m -145.78 118.12 8.44 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.745 0.818 . . . . 0.0 108.936 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 98.1 p -69.21 170.19 10.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.748 0.419 . . . . 0.0 110.871 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.84 175.15 10.32 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 121.358 0.599 . . . . 0.0 110.895 174.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 89.0 mt -75.67 113.03 12.65 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.86 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.533 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 66.6 m-85 -100.97 133.61 45.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.685 0.794 . . . . 0.0 109.319 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.3 m -68.34 -25.56 65.16 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.155 0.582 . . . . 0.0 111.059 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -130.05 147.09 51.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.474 0.71 . . . . 0.0 110.981 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -27.8 68.77 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.781 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.8 p -57.63 -36.69 72.15 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.815 0.846 . . . . 0.0 111.782 175.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.533 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 13.2 m -69.8 -33.03 71.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.605 0.762 . . . . 0.0 110.752 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.67 59.89 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.531 0.732 . . . . 0.0 111.503 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -69.39 -45.26 69.72 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.288 0.635 . . . . 0.0 109.759 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -71.29 -24.72 62.2 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.81 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -64.14 -51.13 55.64 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.543 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.8 tt -71.39 -34.29 53.06 Favored 'Isoleucine or valine' 0 C--N 1.357 0.911 0 CA-C-N 116.641 0.221 . . . . 0.0 111.02 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.72 86.25 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.245 0.545 . . . . 0.0 110.275 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.6 m -74.17 -43.67 56.41 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.365 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 59' ' ' ILE . 13.2 m -65.05 -29.23 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-N 119.046 0.839 . . . . 0.0 111.036 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -76.02 -35.44 59.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.041 0.536 . . . . 0.0 110.277 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -77.83 -31.77 51.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.462 0.705 . . . . 0.0 110.844 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -101.92 12.13 37.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.752 0.821 . . . . 0.0 110.9 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.9 t -64.35 -48.93 74.68 Favored Pre-proline 0 CA--C 1.559 1.325 0 C-N-CA 123.919 0.888 . . . . 0.0 111.285 174.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -78.99 -9.52 15.47 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 121.744 1.629 . . . . 0.0 112.733 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -84.92 81.22 8.99 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -59.68 -28.09 66.98 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.377 1.071 . . . . 0.0 112.256 -177.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -78.54 -23.88 45.97 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NE ' ' HB2' ' A' ' 87' ' ' LYS . 6.5 tpm_? -75.5 -21.9 57.62 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 111.435 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -70.48 133.51 46.88 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 169.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 43.5 mm-40 -96.18 97.11 9.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -78.31 103.63 8.38 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.854 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -122.4 159.49 27.44 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.872 1.269 . . . . 0.0 110.056 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.5 m -128.26 115.94 19.09 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.443 0.697 . . . . 0.0 109.732 174.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.18 156.47 31.66 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.802 0.841 . . . . 0.0 111.342 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.4 m -67.08 -10.8 53.82 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 124.028 0.931 . . . . 0.0 111.811 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.86 4.9 17.66 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 123.902 0.881 . . . . 0.0 110.083 172.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 34.13 67.87 Favored Glycine 0 C--N 1.352 1.434 0 C-N-CA 123.206 0.432 . . . . 0.0 112.731 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.6 mmtt -114.32 124.52 52.2 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.188 0.595 . . . . 0.0 110.211 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.49 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 77.4 m-85 -91.78 125.79 36.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.308 0.643 . . . . 0.0 109.876 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.635 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 25.3 p90 -146.66 174.75 11.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.244 1.018 . . . . 0.0 108.921 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.498 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 44.9 p90 -145.0 135.49 24.29 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.786 0.326 . . . . 0.0 111.345 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.54 ' HB3' HD12 ' A' ' 93' ' ' ILE . 6.1 m-20 -112.48 114.88 27.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.589 0.756 . . . . 0.0 109.328 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 41.5 tp -80.23 119.06 22.48 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.442 ' HB2' ' NE ' ' A' ' 71' ' ' ARG . 34.0 mmtp -87.11 156.85 19.55 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.009 0.924 . . . . 0.0 111.27 -177.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.6 175.14 5.6 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.227 167.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.39 -28.25 69.86 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.525 0.678 . . . . 0.0 110.63 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -81.91 10.81 5.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.456 1.103 . . . . 0.0 112.153 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 66.59 4.89 3.54 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.78 1.232 . . . . 0.0 111.983 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -85.38 140.83 30.45 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.771 0.828 . . . . 0.0 110.427 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.54 HD12 ' HB3' ' A' ' 85' ' ' ASN . 20.5 mm -76.14 99.67 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 14.2 pt -79.44 -11.37 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.019 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.38 108.2 0.26 Allowed Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.3 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.423 ' HB3' HG21 ' A' ' 93' ' ' ILE . 77.8 p -92.01 134.54 34.72 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -88.39 160.32 17.63 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.169 0.509 . . . . 0.0 109.855 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.82 141.42 48.01 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.865 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.635 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.1 ptt? -73.47 116.51 14.13 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.413 0.625 . . . . 0.0 109.645 -176.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -93.35 158.32 15.8 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.252 -176.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 -54.68 7.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 122.567 0.347 . . . . 0.0 110.453 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 p -97.36 155.85 16.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.371 0.668 . . . . 0.0 111.782 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -70.49 -33.54 71.34 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.641 0.777 . . . . 0.0 110.895 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -63.08 -32.19 73.51 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.004 0.522 . . . . 0.0 111.292 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -71.48 -30.1 65.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.432 0.693 . . . . 0.0 110.662 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.49 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 57.5 ttp180 -69.77 -38.73 76.85 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.319 0.648 . . . . 0.0 109.949 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 22.3 mm-40 -71.14 -40.08 71.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.244 0.618 . . . . 0.0 110.986 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.4 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.466 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.94 -44.63 97.56 Favored Glycine 0 C--N 1.347 1.18 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.471 174.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.93 -46.44 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.435 0.694 . . . . 0.0 109.961 176.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.48 80.23 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.923 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.5 t -76.0 -44.15 40.89 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.993 0.517 . . . . 0.0 110.451 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 87.5 t -68.57 -27.78 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.004 0.522 . . . . 0.0 110.229 177.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -69.89 -37.83 76.16 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.002 0.521 . . . . 0.0 110.706 173.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.22 -51.06 16.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.448 0.699 . . . . 0.0 111.74 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -89.28 -13.95 36.92 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 111.14 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.81 -20.71 70.23 Favored Glycine 0 C--N 1.349 1.255 0 CA-C-N 116.473 -0.33 . . . . 0.0 113.164 178.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.6 p -72.19 -10.87 60.36 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.915 0.486 . . . . 0.0 111.263 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.7 t -84.02 172.91 11.59 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.681 0.792 . . . . 0.0 110.179 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -148.29 24.94 1.01 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.782 0.833 . . . . 0.0 109.064 175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -73.94 83.0 1.71 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.589 0.756 . . . . 0.0 110.794 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 47.1 t -89.53 120.63 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.722 0.809 . . . . 0.0 110.617 -176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 68.3 mttm -93.04 113.54 25.83 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.392 1.077 . . . . 0.0 108.708 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.13 96.1 2.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.766 0.794 . . . . 0.0 109.938 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -92.27 -7.77 47.14 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.849 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.478 0.957 0 C-N-CA 124.373 1.069 . . . . 0.0 111.178 172.451 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.317 0 CA-C-O 120.933 0.185 . . . . 0.0 113.176 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -140.1 158.38 44.15 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.877 1.271 . . . . 0.0 109.526 -176.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.451 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 66.2 m-85 -98.85 146.94 25.43 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.636 0.775 . . . . 0.0 109.43 173.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -133.55 111.57 10.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.619 0.768 . . . . 0.0 109.122 174.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -80.3 95.94 6.49 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 173.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -104.27 -177.38 3.35 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.003 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 29' ' ' ASN . 22.0 ptmt -135.01 146.45 49.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.136 0.574 . . . . 0.0 109.657 174.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.4 m -78.12 169.72 17.8 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.54 0.736 . . . . 0.0 110.344 170.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.52 -10.98 59.12 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.101 0.56 . . . . 0.0 111.177 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -86.87 8.58 22.36 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.059 0.943 . . . . 0.0 111.569 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.504 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 42.3 m-80 69.46 7.94 6.5 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.482 1.513 . . . . 0.0 112.88 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HB2' HD12 ' A' ' 48' ' ' LEU . 11.6 mm-40 -84.74 137.59 33.12 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.001 0.52 . . . . 0.0 110.086 -178.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -91.72 134.05 35.06 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.978 0.911 . . . . 0.0 109.854 -172.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -152.87 141.26 20.65 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.625 0.77 . . . . 0.0 108.967 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -98.59 141.06 31.91 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 28.8 m -113.04 133.37 59.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 172.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.5 OUTLIER -88.0 108.04 19.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 167.645 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 4.3 ttmp? -111.54 114.86 28.22 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.155 0.982 . . . . 0.0 109.657 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.42 173.21 2.17 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.173 0.989 . . . . 0.0 112.602 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.15 -15.91 61.47 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.511 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -74.83 -6.06 46.95 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.059 0.944 . . . . 0.0 111.671 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.74 14.94 80.34 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -117.36 137.45 52.45 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.049 0.94 . . . . 0.0 109.97 -177.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 60.8 m -76.82 121.64 23.66 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.364 0.666 . . . . 0.0 110.401 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.5 pt -89.49 -19.84 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.008 0.923 . . . . 0.0 110.843 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 tp -159.89 118.37 2.73 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -172.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 55.4 m -111.31 127.35 55.61 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.457 0.703 . . . . 0.0 109.377 175.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.9 t -81.56 170.2 16.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.603 0.361 . . . . 0.0 111.13 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -83.22 -175.77 5.99 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.476 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.5 mm? -85.5 113.62 21.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.753 -172.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.435 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 75.8 m-85 -107.26 119.58 39.8 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.825 0.85 . . . . 0.0 108.721 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 81.4 p -61.71 -33.48 74.1 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.561 0.744 . . . . 0.0 111.644 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -113.75 135.8 53.55 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.095 0.958 . . . . 0.0 109.092 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.32 -28.15 67.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.452 0.701 . . . . 0.0 111.126 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.8 p -57.39 -36.21 70.98 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.074 0.95 . . . . 0.0 111.698 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 24.9 m -71.45 -28.85 64.25 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.252 0.621 . . . . 0.0 111.407 177.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.56 -32.11 57.96 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.608 0.763 . . . . 0.0 111.29 173.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -73.4 -34.07 65.32 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.597 0.759 . . . . 0.0 110.577 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -78.09 -26.34 48.06 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.701 170.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.39 -41.91 94.19 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.361 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.495 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -71.99 -32.41 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 175.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.22 -32.91 74.42 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.752 0.421 . . . . 0.0 110.738 172.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.2 m -69.3 -53.74 18.18 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.381 176.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.495 HG22 ' HA ' ' A' ' 59' ' ' ILE . 16.4 m -63.9 -29.1 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 123.047 0.217 . . . . 0.0 111.269 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -55.85 17.6 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.827 0.851 . . . . 0.0 108.728 178.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.9 t -66.52 -23.6 66.26 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.333 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.19 4.7 46.84 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.962 0.905 . . . . 0.0 112.28 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.1 m -66.76 -48.12 53.51 Favored Pre-proline 0 CA--C 1.565 1.531 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.254 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.95 -16.1 23.23 Favored 'Trans proline' 0 C--N 1.398 3.134 0 C-N-CA 121.814 1.676 . . . . 0.0 112.728 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -84.63 99.84 11.05 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.211 0.604 . . . . 0.0 110.394 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.67 -23.42 65.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.929 0.891 . . . . 0.0 112.535 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -73.3 -30.18 63.21 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.149 0.979 . . . . 0.0 110.615 -176.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -75.97 -12.04 60.07 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.41 0.684 . . . . 0.0 112.055 -171.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -129.17 145.77 51.24 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.579 0.351 . . . . 0.0 110.282 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.424 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 36.8 tt0 -130.7 147.24 52.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.531 0.732 . . . . 0.0 109.875 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.06 112.57 5.76 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 74.7 mmtt -111.9 142.04 44.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.666 0.787 . . . . 0.0 111.459 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 55.4 m -123.55 117.63 25.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.452 0.701 . . . . 0.0 109.352 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.04 168.4 6.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.375 1.07 . . . . 0.0 112.232 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.3 m -64.56 -24.45 67.6 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.223 1.009 . . . . 0.0 112.079 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.47 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 14.7 m120 -89.21 9.78 24.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 0.0 111.337 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.0 5.43 89.74 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 116.499 -0.318 . . . . 0.0 113.326 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 73.2 mmtt -73.36 152.56 40.82 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.473 0.709 . . . . 0.0 110.311 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 92.7 m-85 -113.27 126.73 55.73 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.303 0.641 . . . . 0.0 109.989 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.83 -179.92 8.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.066 1.346 . . . . 0.0 108.295 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -139.38 172.26 13.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.989 -0.444 . . . . 0.0 109.948 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -145.31 141.9 28.96 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.669 0.388 . . . . 0.0 110.489 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.59 140.11 31.69 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.929 0.892 . . . . 0.0 109.214 177.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -121.78 158.83 27.96 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.66 1.584 . . . . 0.0 110.247 -172.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -128.63 -176.48 3.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.831 0.852 . . . . 0.0 110.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.44 -22.02 66.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.721 0.808 . . . . 0.0 111.625 175.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -73.24 -16.72 61.4 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.522 1.129 . . . . 0.0 111.315 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 m80 67.15 14.68 9.86 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.324 1.45 . . . . 0.0 111.025 -167.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -88.36 161.76 16.93 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.493 0.717 . . . . 0.0 110.269 177.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.3 mm -84.66 104.08 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.948 -1.023 . . . . 0.0 108.352 174.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.84 -2.33 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.005 0.522 . . . . 0.0 110.471 173.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.59 146.49 8.88 Favored Glycine 0 C--N 1.341 0.851 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.3 p -156.61 123.48 5.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.173 0.989 . . . . 0.0 108.761 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.9 m -72.43 171.89 11.44 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.315 1.046 . . . . 0.0 112.649 -171.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.41 150.7 38.26 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 171.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.62 115.27 12.83 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -100.66 150.34 22.84 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.65 -31.91 52.94 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.388 0.275 . . . . 0.0 110.971 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.3 p -110.81 148.7 31.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.065 0.546 . . . . 0.0 111.778 -174.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.32 -24.4 61.3 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.421 1.089 . . . . 0.0 112.353 -175.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -68.78 -32.91 72.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.276 0.631 . . . . 0.0 111.54 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.5 m -68.76 -31.38 70.37 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.015 0.526 . . . . 0.0 112.368 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.413 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 38.6 ptt180 -75.99 -39.75 55.19 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 117.421 0.101 . . . . 0.0 110.875 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -76.91 -28.64 55.39 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -66.41 -38.4 87.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 168.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.35 -37.06 92.49 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.748 174.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.9 mm -59.39 -51.44 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.546 0.739 . . . . 0.0 109.572 174.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.79 68.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.671 0.789 . . . . 0.0 111.353 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.3 t -75.52 -33.81 60.75 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.897 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.1 t -70.45 -35.05 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 122.971 0.508 . . . . 0.0 110.235 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -67.53 -34.27 76.74 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.564 0.746 . . . . 0.0 111.053 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -50.17 8.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.167 0.587 . . . . 0.0 111.294 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -89.22 -1.77 58.21 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.695 0.798 . . . . 0.0 112.208 -170.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.07 -25.12 76.3 Favored Glycine 0 C--N 1.339 0.721 0 CA-C-O 120.144 -0.254 . . . . 0.0 112.747 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.3 t -89.28 -5.96 57.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.481 0.712 . . . . 0.0 111.38 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.0 m -66.03 143.21 57.5 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.956 0.502 . . . . 0.0 110.684 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -111.65 8.21 20.73 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.624 0.769 . . . . 0.0 110.742 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 23.4 m -77.38 91.62 3.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.866 0.867 . . . . 0.0 110.792 -175.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.6 t -104.24 113.05 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.609 0.764 . . . . 0.0 109.827 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 43.8 mtpt -101.38 110.27 22.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.583 0.753 . . . . 0.0 109.905 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -76.82 94.45 3.88 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-O 122.149 0.976 . . . . 0.0 110.094 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -95.25 7.79 45.08 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 110.707 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 CA--C 1.553 1.065 0 C-N-CA 123.715 0.806 . . . . 0.0 111.344 177.629 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.607 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -159.72 153.79 23.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.469 0.708 . . . . 0.0 110.276 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -100.03 152.09 20.62 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.932 173.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -133.08 114.66 14.17 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.872 0.869 . . . . 0.0 109.18 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 52' ' ' LYS . 40.8 tp -80.5 98.32 7.52 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -102.45 179.5 4.28 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.448 1.099 . . . . 0.0 109.306 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -146.48 145.07 30.06 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 168.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.3 m -81.45 -173.35 4.32 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.279 0.632 . . . . 0.0 111.422 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -63.06 -22.6 66.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.799 0.84 . . . . 0.0 111.115 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.26 -16.74 61.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.501 1.12 . . . . 0.0 111.95 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 71.58 11.27 6.49 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.543 1.537 . . . . 0.0 111.795 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.14 138.09 35.91 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.526 0.73 . . . . 0.0 109.102 174.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -89.57 138.36 31.53 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 110.33 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -149.5 130.89 14.71 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.118 0.967 . . . . 0.0 108.99 -168.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -90.77 143.49 26.68 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.77 131.64 71.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 166.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.26 110.18 22.41 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -98.39 123.51 42.56 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 171.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.4 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.96 178.87 0.75 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.578 0.751 . . . . 0.0 111.478 176.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.91 -20.83 54.35 Favored Glycine 0 CA--C 1.54 1.65 0 CA-C-O 121.105 0.28 . . . . 0.0 112.652 172.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.82 -23.29 65.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.367 1.467 . . . . 0.0 111.993 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.16 -3.86 82.58 Favored Glycine 0 C--N 1.35 1.31 0 C-N-CA 123.307 0.48 . . . . 0.0 112.521 -173.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -88.28 134.08 33.89 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.775 1.23 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -71.85 120.53 17.58 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.4 HD13 ' HB2' ' A' ' 37' ' ' ALA . 28.3 pt -108.3 -25.55 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 125.041 1.337 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.423 HD13 HG21 ' A' ' 113' ' ' VAL . 16.4 tp -140.32 151.42 45.03 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.286 1.034 . . . . 0.0 108.552 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.0 m -151.01 110.62 4.02 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.097 0.959 . . . . 0.0 108.649 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.448 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 18.8 m -63.57 165.32 8.22 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.314 0.646 . . . . 0.0 110.942 175.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.96 179.82 4.71 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.283 0.563 . . . . 0.0 111.414 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.74 114.75 22.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -106.17 142.39 35.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.197 0.999 . . . . 0.0 109.384 -178.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.0 t -65.52 -26.72 68.03 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.407 0.683 . . . . 0.0 111.454 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -139.41 150.42 45.24 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.01 0.924 . . . . 0.0 109.559 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.601 ' HB2' HD21 ' A' ' 23' ' ' LEU . 20.3 pttm -62.67 -26.57 68.72 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.613 0.571 . . . . 0.0 110.841 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.439 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 82.1 p -50.97 -47.36 61.31 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.091 1.357 . . . . 0.0 112.122 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.2 m -71.71 -26.63 62.57 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.74 . . . . 0.0 111.552 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.75 63.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.616 0.767 . . . . 0.0 110.23 174.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.83 -37.82 76.34 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.097 0.959 . . . . 0.0 110.206 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 53' ' ' THR . 29.2 mtpp -66.47 -33.53 75.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.608 170.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.06 -49.78 74.62 Favored Glycine 0 C--N 1.35 1.339 0 O-C-N 124.071 0.857 . . . . 0.0 112.762 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.508 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -70.42 -36.11 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 117.15 0.475 . . . . 0.0 110.9 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.54 -39.33 79.9 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.114 0.483 . . . . 0.0 110.301 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.1 m -74.47 -43.28 56.82 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.858 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.508 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -66.1 -28.79 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 119.11 0.868 . . . . 0.0 110.319 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.4 tpt85 -68.16 -39.23 82.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.678 0.791 . . . . 0.0 109.869 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.7 m -78.35 -24.05 46.65 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.691 0.796 . . . . 0.0 111.509 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -105.32 13.69 30.02 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.107 0.963 . . . . 0.0 111.21 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.9 m -55.93 -45.36 99.91 Favored Pre-proline 0 CA--C 1.569 1.676 0 C-N-CA 123.591 0.756 . . . . 0.0 112.148 172.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -87.93 -14.09 3.63 Favored 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 121.796 1.664 . . . . 0.0 113.951 175.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.38 93.12 4.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.033 0.533 . . . . 0.0 110.769 -170.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.09 -32.37 72.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.948 1.299 . . . . 0.0 112.565 -173.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -68.85 -26.04 64.95 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.551 0.74 . . . . 0.0 111.041 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -77.06 -26.05 53.13 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.572 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.468 ' HB3' HD12 ' A' ' 110' ' ' ILE . 95.9 m-85 -82.58 97.12 8.31 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 171.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -110.28 146.42 35.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.83 0.452 . . . . 0.0 109.888 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -87.01 149.32 24.84 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.798 1.239 . . . . 0.0 109.469 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -155.77 129.15 8.28 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.209 0.603 . . . . 0.0 109.857 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 48.2 m -92.27 121.42 33.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.954 0.502 . . . . 0.0 109.658 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 160.98 6.24 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.248 1.019 . . . . 0.0 111.908 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.2 t -72.37 -9.99 59.21 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.803 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -72.44 -10.32 59.65 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.744 0.818 . . . . 0.0 111.199 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.47 -6.05 84.02 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.35 0.5 . . . . 0.0 112.523 -175.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -92.28 159.15 15.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.735 0.814 . . . . 0.0 110.333 -174.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -105.75 128.89 53.97 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 -166.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.48 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 26.5 p90 -139.2 177.83 7.62 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -123.76 171.27 9.75 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.086 0.47 . . . . 0.0 110.07 176.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -148.08 121.78 9.24 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 124.154 0.981 . . . . 0.0 108.434 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.536 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -83.64 97.99 9.38 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -84.46 145.7 28.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.324 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -110.99 170.78 7.87 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.624 0.769 . . . . 0.0 110.839 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.29 -9.4 53.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.889 0.876 . . . . 0.0 111.673 173.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -88.01 6.26 36.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.229 1.011 . . . . 0.0 111.883 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 77.4 m80 69.92 -2.74 1.93 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 125.058 1.343 . . . . 0.0 112.34 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -99.06 150.98 21.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.432 0.693 . . . . 0.0 109.626 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.599 HG21 ' HB3' ' A' ' 96' ' ' SER . 50.4 mt -87.52 108.92 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 173.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.536 HD11 HD22 ' A' ' 86' ' ' LEU . 9.9 pt -79.32 -5.83 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.729 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . 178.67 113.91 0.39 Allowed Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 173.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.599 ' HB3' HG21 ' A' ' 93' ' ' ILE . 52.5 p -112.33 151.22 29.98 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.917 0.858 . . . . 0.0 109.743 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.9 t -81.11 166.49 20.65 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.31 -78.02 0.15 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.15 0.58 . . . . 0.0 109.87 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.48 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 23.3 ptm -175.75 122.51 0.19 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.283 1.033 . . . . 0.0 108.943 -176.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -102.97 115.86 31.43 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.97 90.9 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.039 0.536 . . . . 0.0 110.207 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.0 p -90.23 120.05 31.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.847 0.859 . . . . 0.0 109.226 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -24.64 65.9 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.207 1.003 . . . . 0.0 113.114 -171.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.94 -29.39 69.8 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.239 0.616 . . . . 0.0 111.868 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.8 m -71.77 -21.22 61.76 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.871 0.868 . . . . 0.0 111.417 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.72 -40.64 88.48 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.486 0.714 . . . . 0.0 109.529 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.86 -47.38 85.3 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.359 1.063 . . . . 0.0 110.919 174.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.1 m -60.75 -36.52 79.11 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.193 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -62.44 -42.53 99.7 Favored Glycine 0 C--N 1.35 1.311 0 O-C-N 123.627 0.58 . . . . 0.0 112.881 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.468 HD12 ' HB3' ' A' ' 72' ' ' TYR . 32.5 mm -58.09 -47.1 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.197 0.599 . . . . 0.0 110.145 175.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.87 -32.3 72.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.207 1.003 . . . . 0.0 111.602 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.0 t -74.2 -41.53 61.25 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.274 0.63 . . . . 0.0 110.306 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.423 HG21 HD13 ' A' ' 44' ' ' LEU . 94.1 t -75.91 -26.34 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.192 0.597 . . . . 0.0 110.684 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -64.41 -39.79 94.52 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.204 0.602 . . . . 0.0 109.845 169.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.1 -47.02 21.61 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.128 0.971 . . . . 0.0 111.878 -177.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -101.58 -2.72 29.85 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.674 0.79 . . . . 0.0 112.195 -170.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -75.91 -8.88 85.12 Favored Glycine 0 N--CA 1.475 1.287 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 82.7 p -80.25 -12.84 59.58 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.28 1.032 . . . . 0.0 111.567 174.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.8 m -69.97 118.23 12.55 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.904 0.882 . . . . 0.0 110.733 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -82.94 -17.71 42.65 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.409 0.683 . . . . 0.0 110.766 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.4 m -61.93 92.62 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.942 0.897 . . . . 0.0 112.425 -174.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 84.0 t -88.53 101.39 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.688 170.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -87.21 143.78 27.13 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 169.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -104.73 138.77 40.52 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.278 0.561 . . . . 0.0 110.819 -178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -129.94 -2.31 4.65 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.736 1.214 . . . . 0.0 109.912 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 37.1 p . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.043 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.579 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.468 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.2 p90 -154.76 168.84 25.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.677 0.791 . . . . 0.0 111.103 -171.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 46.1 m-85 -110.57 148.8 31.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.67 1.188 . . . . 0.0 108.438 172.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 39.3 mt-10 -133.39 111.28 10.64 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 171.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 31' ' ' PHE . 26.9 tp -83.37 100.29 10.59 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.417 0.627 . . . . 0.0 109.606 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m -93.83 178.41 5.68 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.688 1.195 . . . . 0.0 110.051 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -130.37 163.13 27.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.554 0.742 . . . . 0.0 109.442 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -120.98 -169.46 1.84 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.763 0.825 . . . . 0.0 110.523 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.0 m -63.46 -30.43 71.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.96 0.904 . . . . 0.0 112.657 -170.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -89.0 12.51 15.27 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.146 0.578 . . . . 0.0 111.267 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.6 t30 63.36 20.91 12.53 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.046 1.339 . . . . 0.0 110.48 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -87.23 142.08 28.17 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.732 0.813 . . . . 0.0 110.169 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.491 ' HB3' HD11 ' A' ' 23' ' ' LEU . 79.7 m-85 -90.96 130.71 36.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.905 1.282 . . . . 0.0 110.742 -165.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 46' ' ' SER . 47.5 ttm-85 -134.88 127.34 30.52 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.749 1.22 . . . . 0.0 108.611 -174.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.97 135.16 33.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.5 m -113.96 131.31 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 165.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.428 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.6 OUTLIER -104.56 115.66 30.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -113.92 138.88 49.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.506 0.722 . . . . 0.0 109.684 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 174.4 11.63 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.217 0.607 . . . . 0.0 109.941 170.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.84 -14.78 68.25 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.972 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -70.8 -11.56 61.03 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.722 1.209 . . . . 0.0 111.478 174.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 88.4 0.5 82.32 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.908 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -96.42 141.73 29.37 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.699 0.799 . . . . 0.0 110.997 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.4 m -79.1 119.89 22.86 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.011 0.819 . . . . 0.0 109.335 175.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.403 HD11 HD22 ' A' ' 35' ' ' LEU . 26.2 pt -92.35 -30.53 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.271 1.028 . . . . 0.0 111.106 -178.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.4 tp -148.55 150.59 33.62 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.808 0.843 . . . . 0.0 109.131 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.474 HG22 HH11 ' A' ' 32' ' ' ARG . 55.6 m -136.31 109.92 8.03 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.493 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 13.2 m -66.83 153.3 43.75 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.449 0.7 . . . . 0.0 109.682 173.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -82.89 -167.91 1.84 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.117 0.567 . . . . 0.0 112.195 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.18 145.21 37.8 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.464 0.706 . . . . 0.0 111.731 -173.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 96.2 m-85 -134.65 133.61 40.29 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.35 1.46 . . . . 0.0 107.732 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.4 m -61.39 -36.94 81.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.123 0.569 . . . . 0.0 110.707 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.6 m -126.31 150.68 48.34 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.333 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -67.99 -24.51 65.14 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.349 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -62.17 -36.34 81.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.45 0.7 . . . . 0.0 111.464 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.7 m -69.63 -35.38 75.18 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.229 0.612 . . . . 0.0 109.974 173.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.0 69.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.778 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -67.84 -34.82 77.45 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.25 0.62 . . . . 0.0 110.303 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -67.14 -35.88 80.67 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.099 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.21 -49.33 71.97 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 123.925 0.766 . . . . 0.0 113.337 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.5 tt -67.74 -33.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 116.961 0.38 . . . . 0.0 111.008 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.19 -37.61 87.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.845 0.458 . . . . 0.0 110.406 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.9 m -74.41 -39.5 62.61 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.029 -178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 20.2 m -67.23 -33.41 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.774 0.715 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -73.91 -35.16 64.6 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.894 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.6 t -76.25 -21.48 56.29 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.522 0.729 . . . . 0.0 110.673 176.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.565 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 0.9 OUTLIER -95.06 8.33 43.3 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.917 0.887 . . . . 0.0 110.885 176.864 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 39.8 t -67.49 -47.45 47.15 Favored Pre-proline 0 CA--C 1.572 1.819 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.397 171.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.93 -26.37 26.83 Favored 'Trans proline' 0 C--N 1.4 3.263 0 C-N-CA 121.957 1.771 . . . . 0.0 112.142 168.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 65' ' ' ASN . 12.0 mm100 -92.55 46.69 1.26 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.899 0.88 . . . . 0.0 109.191 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -67.44 -13.02 61.65 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -73.37 -26.04 60.84 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.786 0.834 . . . . 0.0 110.562 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.44 HH21 ' HG2' ' A' ' 73' ' ' GLU . 3.6 tpm_? -70.78 -16.29 62.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.899 0.88 . . . . 0.0 112.269 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -63.46 122.48 16.37 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 168.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HG2' HH21 ' A' ' 71' ' ' ARG . 38.0 mt-10 -94.6 110.92 22.7 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -172.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.03 104.31 1.11 Allowed 'General case' 0 C--N 1.353 0.741 0 O-C-N 123.9 0.75 . . . . 0.0 110.062 -178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -95.37 143.93 26.33 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.664 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.5 m -127.24 115.43 19.03 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.74 155.48 37.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.674 0.79 . . . . 0.0 110.573 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -68.63 -13.12 62.14 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.53 0.732 . . . . 0.0 110.685 175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -77.31 4.65 10.22 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.024 0.929 . . . . 0.0 111.713 172.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.21 17.86 77.67 Favored Glycine 0 C--N 1.351 1.413 0 C-N-CA 122.885 0.278 . . . . 0.0 113.089 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -104.7 125.8 51.15 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.831 0.852 . . . . 0.0 110.274 -176.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -79.7 137.42 37.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 172.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -150.83 176.81 10.71 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -138.21 140.82 39.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 122.048 -0.408 . . . . 0.0 110.483 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -110.74 114.34 27.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 171.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -80.73 125.29 29.87 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -109.58 138.99 45.13 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.071 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.22 161.81 13.95 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.44 0.696 . . . . 0.0 110.685 175.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.72 69.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.921 0.888 . . . . 0.0 111.323 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.41 12.26 3.81 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.555 1.142 . . . . 0.0 112.539 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 66.35 14.11 9.53 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.853 1.261 . . . . 0.0 111.677 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -88.9 128.85 35.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.494 0.718 . . . . 0.0 109.135 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.8 96.91 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.7 pt -83.46 -7.07 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.081 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -162.59 145.18 10.36 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 173.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.9 p -155.45 118.78 4.4 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.3 t -81.76 164.42 21.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 122.758 0.423 . . . . 0.0 110.615 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -75.02 -84.59 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.119 0.568 . . . . 0.0 110.085 -176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 12.7 ptp -164.55 129.73 2.74 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.975 0.91 . . . . 0.0 109.504 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 81.0 m-85 -104.25 131.76 51.22 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.649 0.78 . . . . 0.0 109.719 173.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.37 -31.37 72.02 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.958 0.903 . . . . 0.0 111.645 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 17.5 p -140.81 165.64 26.96 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.976 0.91 . . . . 0.0 110.557 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -30.7 69.53 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.399 1.08 . . . . 0.0 112.065 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -61.11 -37.44 82.8 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 123.953 0.783 . . . . 0.0 111.385 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.485 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 21.5 m -74.58 -30.78 61.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.01 0.924 . . . . 0.0 110.569 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -39.4 88.69 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.085 0.954 . . . . 0.0 110.089 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.43 -36.93 77.14 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.795 0.838 . . . . 0.0 110.71 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.0 m -62.86 -37.63 87.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.529 0.732 . . . . 0.0 109.482 172.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.432 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.92 -48.56 82.84 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.427 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.0 mm -55.23 -50.01 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.331 0.652 . . . . 0.0 110.095 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.69 -39.35 84.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 13.7 t -76.15 -36.01 58.95 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.86 -175.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 109' ' ' GLY . 85.5 t -71.16 -31.9 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 118.141 0.428 . . . . 0.0 110.198 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -69.23 -43.37 74.19 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.633 0.373 . . . . 0.0 110.766 174.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.71 -48.15 56.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.565 0.746 . . . . 0.0 111.327 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -88.8 -10.54 47.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.874 0.87 . . . . 0.0 111.576 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.44 -37.15 89.93 Favored Glycine 0 C--N 1.346 1.136 0 O-C-N 123.245 0.341 . . . . 0.0 112.785 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.1 t -75.78 -11.14 59.93 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.934 0.894 . . . . 0.0 112.239 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.2 m -69.5 104.56 2.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.179 0.592 . . . . 0.0 110.135 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -86.28 72.47 10.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.222 1.011 . . . . 0.0 108.802 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.468 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.1 t -145.42 93.83 2.43 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.041 -1.436 . . . . 0.0 108.898 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.2 t -109.24 123.79 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.974 0.91 . . . . 0.0 110.542 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -100.7 90.26 4.18 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 174.289 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.94 97.16 1.8 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ASN . . . . . 0.405 ' ND2' ' HB3' ' A' ' 22' ' ' GLU . 87.2 m-20 -84.54 -4.12 58.79 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.561 1.144 . . . . 0.0 112.445 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.416 HG21 ' HD1' ' A' ' 31' ' ' PHE . 47.3 p . . . . . 0 CA--C 1.543 0.677 0 C-N-CA 123.315 0.646 . . . . 0.0 111.202 -176.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.547 0 N-CA-C 111.92 -0.472 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.2 p90 -159.05 150.13 20.12 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.799 0.839 . . . . 0.0 109.88 -178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -90.57 157.48 17.49 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.607 0.763 . . . . 0.0 109.56 172.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.477 ' HA ' ' HB3' ' A' ' 123' ' ' LYS . 55.3 mt-10 -136.09 110.49 8.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.69 0.796 . . . . 0.0 109.565 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.457 HD21 ' HG3' ' A' ' 52' ' ' LYS . 29.2 tp -94.18 101.68 13.68 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.197 0.599 . . . . 0.0 109.849 -178.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.551 ' HA ' ' HB3' ' A' ' 125' ' ' ASN . 22.3 m -107.04 174.49 5.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.239 1.016 . . . . 0.0 110.702 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.39 151.65 36.59 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.199 0.999 . . . . 0.0 109.58 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.8 m -89.43 -177.65 5.39 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.771 0.829 . . . . 0.0 111.428 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.6 t -61.92 -34.82 76.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.952 0.901 . . . . 0.0 110.943 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.38 11.52 36.33 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.782 0.833 . . . . 0.0 111.078 176.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 t30 69.42 33.78 3.06 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 125.349 1.46 . . . . 0.0 112.559 174.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -81.12 139.27 35.73 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 121.748 -0.595 . . . . 0.0 110.027 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -90.16 117.47 28.95 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.393 1.077 . . . . 0.0 109.485 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -130.18 119.29 22.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.062 0.945 . . . . 0.0 109.264 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -95.24 130.54 41.94 Favored 'General case' 0 C--O 1.241 0.615 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 45' ' ' THR . 20.7 m -106.12 170.75 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 170.104 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.2 125.27 42.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -112.81 138.81 49.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.97 178.49 1.78 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.454 0.702 . . . . 0.0 111.305 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -19.86 61.46 Favored Glycine 0 C--N 1.35 1.327 0 CA-C-N 116.585 -0.28 . . . . 0.0 113.031 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -67.8 -24.35 65.29 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.598 0.759 . . . . 0.0 111.779 173.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.37 15.5 58.58 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 116.537 -0.302 . . . . 0.0 113.025 -175.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -106.77 141.46 37.98 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.421 0.689 . . . . 0.0 110.317 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.9 m -67.77 122.29 17.79 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 123.602 0.564 . . . . 0.0 110.861 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.5 pt -109.85 -18.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.775 1.23 . . . . 0.0 110.651 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 tp -151.06 145.94 25.84 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.498 HG23 HG12 ' A' ' 34' ' ' VAL . 92.5 m -146.4 119.06 8.56 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.842 0.857 . . . . 0.0 108.813 178.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -82.0 177.26 8.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.919 0.487 . . . . 0.0 111.335 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -73.22 175.43 6.82 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.346 1.059 . . . . 0.0 111.725 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.0 114.65 27.25 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.414 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -99.56 147.33 25.45 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.069 0.948 . . . . 0.0 109.323 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.6 p -81.09 -31.99 34.1 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.83 0.452 . . . . 0.0 111.297 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.2 m -109.15 143.7 38.2 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.953 0.901 . . . . 0.0 109.703 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HG3' HD21 ' A' ' 23' ' ' LEU . 87.3 tttt -67.93 -37.89 82.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.978 0.511 . . . . 0.0 110.412 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.172 0.989 . . . . 0.0 111.695 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 m -64.12 -39.2 93.52 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.072 0.949 . . . . 0.0 111.25 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.97 -34.67 66.61 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.578 0.751 . . . . 0.0 110.886 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.94 -29.63 65.71 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.575 0.75 . . . . 0.0 111.1 177.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -77.96 -27.41 49.23 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.322 0.249 . . . . 0.0 111.275 170.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.85 -40.84 99.37 Favored Glycine 0 C--N 1.344 1.002 0 O-C-N 123.525 0.516 . . . . 0.0 112.827 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.449 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.4 tt -68.01 -32.82 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 120.91 0.386 . . . . 0.0 111.067 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.17 74.15 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.071 0.548 . . . . 0.0 110.677 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -70.84 -50.83 31.11 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.879 0.871 . . . . 0.0 111.344 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 59' ' ' ILE . 30.7 m -66.18 -28.84 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.293 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -53.16 -50.97 63.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.681 0.793 . . . . 0.0 110.334 -178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -80.79 -31.99 35.54 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.826 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB3' HD11 ' A' ' 86' ' ' LEU . 14.1 m120 -96.06 -8.4 33.6 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 p -65.28 -37.02 17.24 Favored Pre-proline 0 CA--C 1.566 1.584 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -74.13 -7.9 20.37 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.768 1.645 . . . . 0.0 112.993 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.79 88.93 4.44 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 122.923 0.489 . . . . 0.0 109.768 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.458 ' HA ' ' HD1' ' A' ' 72' ' ' TYR . 12.2 pt-20 -62.02 -20.19 63.65 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.801 0.84 . . . . 0.0 111.685 176.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -54.3 -40.74 68.2 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.457 1.103 . . . . 0.0 112.044 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -83.69 -9.43 58.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.514 0.726 . . . . 0.0 112.095 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 85' ' ' ASN . 88.8 m-85 -84.01 124.65 31.28 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.445 ' HB2' ' ND2' ' A' ' 85' ' ' ASN . 41.9 mt-10 -95.5 104.11 16.0 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 173.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -73.14 101.77 3.41 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.731 0.777 . . . . 0.0 109.136 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HE2' ' ND2' ' A' ' 85' ' ' ASN . 65.9 mttm -102.57 165.05 11.31 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.513 1.125 . . . . 0.0 109.937 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.8 m -126.3 112.2 15.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.312 0.645 . . . . 0.0 109.605 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.0 165.54 6.8 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.841 0.856 . . . . 0.0 111.02 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -64.3 -16.31 61.92 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.585 0.754 . . . . 0.0 111.98 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -81.35 -2.05 47.75 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.956 0.902 . . . . 0.0 111.986 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 77.94 14.97 81.76 Favored Glycine 0 C--N 1.349 1.27 0 C-N-CA 122.831 0.253 . . . . 0.0 112.935 -176.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.64 142.68 29.15 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.886 0.874 . . . . 0.0 109.535 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -101.23 125.48 47.86 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.865 0.466 . . . . 0.0 109.832 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.454 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 35.7 p90 -131.74 170.54 14.67 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.505 ' HB2' ' HB3' ' A' ' 97' ' ' SER . 16.6 m-85 -131.22 166.89 20.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.942 0.497 . . . . 0.0 110.142 -173.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.558 ' ND2' ' HE2' ' A' ' 75' ' ' LYS . 4.0 p30 -149.77 133.06 16.45 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 167.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 65' ' ' ASN . 27.2 tp -89.78 116.24 27.73 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -96.88 140.47 31.39 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.933 -176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -98.15 166.04 11.6 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.826 0.85 . . . . 0.0 109.748 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.07 -13.84 62.32 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.088 0.555 . . . . 0.0 111.634 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.478 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 64.4 m-20 -80.1 4.1 18.34 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.816 0.847 . . . . 0.0 111.296 174.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 74.3 m80 67.25 15.46 9.99 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.02 1.328 . . . . 0.0 111.788 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.478 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 13.4 pt20 -97.67 147.02 24.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.194 0.598 . . . . 0.0 110.426 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.96 99.72 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 13.0 pt -81.22 -16.51 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.756 -177.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.83 103.26 0.2 Allowed Glycine 0 C--N 1.35 1.335 0 C-N-CA 121.701 -0.285 . . . . 0.0 113.046 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 85' ' ' ASN . 39.8 t -92.86 113.56 25.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.661 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.505 ' HB3' ' HB2' ' A' ' 84' ' ' PHE . 46.6 t -81.8 135.85 35.43 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -75.43 172.5 12.4 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.454 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.07 118.08 16.6 Favored 'General case' 0 C--N 1.351 0.651 0 CA-C-O 121.801 0.81 . . . . 0.0 112.045 -171.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -93.95 137.09 33.55 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.485 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.16 -56.51 4.58 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.259 0.624 . . . . 0.0 110.818 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.3 p -88.26 151.68 22.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.511 0.724 . . . . 0.0 112.241 -171.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.91 -24.84 60.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.407 1.083 . . . . 0.0 111.973 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -65.81 -37.56 86.58 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.5 m -74.75 -18.59 60.47 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.249 1.02 . . . . 0.0 111.816 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -60.75 -48.95 79.46 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 173.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.7 -48.13 23.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.958 0.903 . . . . 0.0 111.043 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.8 m -61.38 -28.72 69.44 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.704 0.802 . . . . 0.0 111.265 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.449 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -66.26 -51.65 42.22 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.744 178.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.7 mm -65.48 -38.07 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 122.843 0.457 . . . . 0.0 110.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -30.57 71.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.961 0.904 . . . . 0.0 111.486 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.91 -50.08 18.08 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 109' ' ' GLY . 66.2 t -62.17 -36.63 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 C-N-CA 122.972 0.509 . . . . 0.0 111.778 -175.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -69.95 -39.44 76.03 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 120.705 0.288 . . . . 0.0 111.337 178.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.48 -41.57 46.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.326 0.651 . . . . 0.0 111.434 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -91.08 -10.77 40.84 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.5 0.72 . . . . 0.0 110.782 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.22 -12.46 84.58 Favored Glycine 0 C--N 1.354 1.542 0 C-N-CA 122.842 0.258 . . . . 0.0 113.572 177.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.2 p -81.92 -18.31 44.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.259 0.623 . . . . 0.0 111.016 172.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.3 m -76.06 90.34 3.04 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 123.449 0.7 . . . . 0.0 110.046 -178.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.446 ' HA ' HD11 ' A' ' 59' ' ' ILE . 22.7 mm-40 -82.93 67.75 9.14 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 122.185 0.993 . . . . 0.0 109.597 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.6 t -136.65 93.3 2.85 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.0 -1.454 . . . . 0.0 109.244 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 35.4 m -85.93 141.4 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.183 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.477 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 55.5 tptt -97.07 99.3 10.81 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 174.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.85 95.24 1.91 Allowed 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.134 -175.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 24' ' ' SER . 26.5 t-20 -79.06 -26.64 43.05 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 165.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 CA--C 1.548 0.865 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.35 171.519 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.453 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -147.65 148.32 30.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.038 0.935 . . . . 0.0 109.936 -176.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -97.17 118.83 34.48 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -95.58 109.02 21.32 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.61 HD21 ' HB2' ' A' ' 52' ' ' LYS . 49.4 tp -79.72 101.47 8.43 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -103.52 139.8 38.37 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.922 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 126' ' ' THR . 14.8 ptmm? -95.44 130.13 42.36 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 170.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.4 m -83.98 -178.49 6.99 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 109.882 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -59.94 -25.76 65.42 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.066 0.546 . . . . 0.0 112.259 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -102.31 25.71 8.61 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.848 0.859 . . . . 0.0 111.086 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 63.88 12.18 6.58 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 125.035 1.334 . . . . 0.0 112.829 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -69.44 126.25 29.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.344 0.658 . . . . 0.0 110.941 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.48 119.95 30.37 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.195 0.998 . . . . 0.0 109.475 -170.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HB2' HD13 ' A' ' 48' ' ' LEU . 47.2 ttp85 -147.9 117.78 7.17 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.837 0.855 . . . . 0.0 108.972 -173.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -90.99 128.08 36.67 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 45' ' ' THR . 30.5 m -107.06 130.89 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.694 0.797 . . . . 0.0 108.892 173.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.2 tp -89.77 112.93 24.37 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -105.29 129.29 53.68 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.305 1.042 . . . . 0.0 109.059 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.31 -176.98 1.99 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.937 0.495 . . . . 0.0 110.995 173.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.41 -15.06 51.39 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 115.434 0.934 . . . . 0.0 115.434 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -79.77 -14.22 58.87 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.473 0.709 . . . . 0.0 111.723 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.09 6.87 78.25 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 -165.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -84.12 117.43 23.46 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 124.465 1.106 . . . . 0.0 109.961 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.7 m -64.93 119.73 11.26 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 171.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.1 pt -104.91 -24.93 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.292 1.037 . . . . 0.0 109.993 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 13.0 tp -145.61 134.26 22.19 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -170.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.53 HG23 HG12 ' A' ' 34' ' ' VAL . 59.7 m -132.74 123.64 26.63 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.759 0.823 . . . . 0.0 108.951 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 t -83.52 -179.29 7.31 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.292 0.637 . . . . 0.0 111.408 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 93' ' ' ILE . 27.1 mm-40 -68.75 170.32 9.68 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.588 0.755 . . . . 0.0 111.643 174.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.8 mm? -89.65 113.67 25.18 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 171.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -99.1 152.15 20.17 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 124.42 1.088 . . . . 0.0 109.859 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 65.5 p -82.84 -17.58 43.44 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.515 0.726 . . . . 0.0 110.932 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.0 m -138.23 149.51 45.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.114 0.966 . . . . 0.0 110.076 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.61 ' HB2' HD21 ' A' ' 23' ' ' LEU . 3.1 pptp? -71.88 -27.17 62.67 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.194 0.598 . . . . 0.0 110.444 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 14.8 t -68.77 -27.86 66.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.989 0.516 . . . . 0.0 111.046 174.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 14.6 m -69.31 -36.42 76.99 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.034 0.534 . . . . 0.0 109.637 174.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.88 -30.94 67.45 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.167 174.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -64.39 -43.64 93.83 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.883 0.873 . . . . 0.0 110.479 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 53' ' ' THR . 2.8 mmmp? -64.9 -34.05 77.49 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.981 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.63 -49.55 68.3 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.352 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.9 tt -71.4 -32.24 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 122.607 0.363 . . . . 0.0 111.076 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.95 -38.69 86.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.158 0.504 . . . . 0.0 109.796 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.6 m -71.48 -43.22 66.97 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.796 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 m -62.36 -32.65 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 118.897 0.771 . . . . 0.0 110.608 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.484 HH22 ' N ' ' A' ' 120' ' ' GLN . 14.9 ttm180 -70.39 -40.11 74.15 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.677 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -68.63 -22.28 64.43 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.101 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.48 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 60.7 m-80 -98.54 -1.94 39.91 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.441 0.696 . . . . 0.0 112.156 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.1 m -63.15 -45.76 85.85 Favored Pre-proline 0 CA--C 1.568 1.663 0 CA-C-O 118.275 -0.869 . . . . 0.0 111.657 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.8 -37.88 8.47 Favored 'Trans proline' 0 C--N 1.398 3.158 0 C-N-CA 121.762 1.641 . . . . 0.0 111.812 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' A' ' 65' ' ' ASN . 9.5 pt20 -98.66 58.28 1.2 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.934 1.35 . . . . 0.0 109.408 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.27 -11.71 34.29 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 113.27 -1.786 . . . . 0.0 112.899 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.19 -25.01 65.03 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.868 0.867 . . . . 0.0 111.894 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.69 -15.6 61.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.011 0.524 . . . . 0.0 112.367 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.82 127.39 31.36 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -96.92 107.33 19.82 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.506 0.722 . . . . 0.0 111.532 -168.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -73.51 112.0 9.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.034 0.534 . . . . 0.0 109.76 174.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.411 ' HE2' ' OD1' ' A' ' 85' ' ' ASN . 55.1 mtmt -134.36 143.5 47.69 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 171.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.3 m -101.49 133.36 46.26 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.55 0.74 . . . . 0.0 109.71 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.4 11.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.121 0.968 . . . . 0.0 111.649 176.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 p -64.47 -25.97 68.23 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.892 0.877 . . . . 0.0 111.473 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -70.02 -23.75 63.17 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.643 0.777 . . . . 0.0 111.332 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.62 30.91 5.97 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.317 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -113.55 125.9 54.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.409 0.683 . . . . 0.0 110.921 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -83.1 128.6 34.63 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.058 0.943 . . . . 0.0 110.391 -170.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -138.37 173.58 11.46 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -131.09 135.53 47.59 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.411 ' OD1' ' HE2' ' A' ' 75' ' ' LYS . 5.2 p-10 -115.51 129.51 56.56 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -91.69 99.38 12.29 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 173.362 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -106.55 135.97 47.13 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.216 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.472 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -100.85 170.71 8.13 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.33 1.052 . . . . 0.0 111.052 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.11 -8.95 13.72 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.509 0.723 . . . . 0.0 112.936 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.65 7.87 18.86 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.082 0.953 . . . . 0.0 111.311 175.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 87' ' ' LYS . 30.7 m170 63.97 21.94 12.79 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.971 1.309 . . . . 0.0 111.687 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -116.82 129.85 56.34 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.831 0.853 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 96' ' ' SER . 40.0 mt -74.05 100.73 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 122.076 0.941 . . . . 0.0 109.519 173.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 86' ' ' LEU . 16.2 pt -75.66 -6.57 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.279 -176.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.01 99.14 0.13 Allowed Glycine 0 C--N 1.353 1.491 0 CA-C-O 120.082 -0.288 . . . . 0.0 112.528 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 93' ' ' ILE . 34.3 p -92.45 116.77 29.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.4 t -69.39 164.5 22.84 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 122.975 0.51 . . . . 0.0 111.248 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -73.0 156.12 39.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.54 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 67.7 mtm -72.9 116.97 14.05 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -90.63 143.5 26.68 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 124.003 0.921 . . . . 0.0 109.17 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.04 -39.38 79.23 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.021 0.528 . . . . 0.0 110.675 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 65.3 p -117.16 150.24 39.03 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.696 0.798 . . . . 0.0 110.949 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -69.78 -25.77 63.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.052 0.941 . . . . 0.0 111.909 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.86 -29.98 68.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.686 0.394 . . . . 0.0 111.535 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -71.27 -23.99 62.07 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.123 0.569 . . . . 0.0 111.318 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.436 ' O ' HG12 ' A' ' 110' ' ' ILE . 13.1 ttt180 -61.34 -49.55 76.53 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.203 0.601 . . . . 0.0 109.754 169.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.31 -38.11 88.14 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.155 0.982 . . . . 0.0 111.223 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 48.4 m -66.32 -37.28 85.02 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.178 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.33 -35.84 88.37 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.903 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 106' ' ' ARG . 43.6 mm -59.83 -46.67 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.02 -35.66 81.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.831 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.6 t -71.1 -42.93 68.65 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.708 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.92 -27.08 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.506 0.723 . . . . 0.0 111.058 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -66.04 -47.42 74.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.011 0.925 . . . . 0.0 108.997 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.39 -47.69 22.39 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.647 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.461 ' HB3' HD11 ' A' ' 35' ' ' LEU . 77.9 m-20 -83.66 -14.37 51.98 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.51 0.724 . . . . 0.0 111.952 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -70.62 -30.57 68.53 Favored Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.104 -0.399 . . . . 0.0 112.104 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -91.17 9.18 32.18 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.025 0.93 . . . . 0.0 111.343 175.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -103.51 108.68 20.04 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.182 0.993 . . . . 0.0 108.852 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.484 ' N ' HH22 ' A' ' 63' ' ' ARG . 48.5 tt0 -92.82 38.66 1.03 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.276 0.63 . . . . 0.0 111.108 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.3 m -79.26 75.72 5.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 t -91.04 97.5 7.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -77.54 125.55 29.52 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.652 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -77.47 95.17 4.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 172.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.32 -0.75 57.23 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 121.595 0.712 . . . . 0.0 109.44 174.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.424 HG22 ' HB3' ' A' ' 25' ' ' LYS . 25.9 p . . . . . 0 CA--C 1.549 0.908 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 169.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.485 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -145.16 150.06 36.08 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.413 1.085 . . . . 0.0 110.186 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -95.34 153.03 17.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.843 0.857 . . . . 0.0 109.46 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -133.32 109.77 9.6 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.5 tp -82.01 102.0 10.69 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -101.11 -177.63 3.51 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.432 1.093 . . . . 0.0 109.507 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 18.7 ptpt -138.71 165.9 25.77 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.041 0.536 . . . . 0.0 109.757 169.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.3 t -100.55 -174.07 2.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.861 0.864 . . . . 0.0 108.878 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 t -62.28 -35.28 78.53 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.458 0.703 . . . . 0.0 111.525 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -90.79 26.37 2.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.154 0.582 . . . . 0.0 111.532 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.508 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.2 m-20 62.99 19.22 11.5 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.536 1.134 . . . . 0.0 112.263 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -71.52 116.5 11.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.671 0.788 . . . . 0.0 109.731 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.5 120.61 28.02 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.001 0.521 . . . . 0.0 110.06 -168.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 ttt85 -142.51 116.25 9.23 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.028 1.331 . . . . 0.0 108.116 -170.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -102.91 145.83 29.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.241 0.544 . . . . 0.0 110.597 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.573 HG12 HG23 ' A' ' 45' ' ' THR . 29.5 m -106.86 171.4 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 108.789 175.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 24.3 tp -137.54 109.56 7.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 173.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 65.5 mttm -95.14 141.93 28.18 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 178.05 7.01 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 168.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.52 -18.22 63.21 Favored Glycine 0 N--CA 1.48 1.596 0 C-N-CA 122.898 0.285 . . . . 0.0 113.035 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -63.73 -21.57 66.47 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 125.156 1.382 . . . . 0.0 111.89 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.82 2.22 75.66 Favored Glycine 0 C--N 1.35 1.354 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -173.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -98.35 130.43 45.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.918 1.287 . . . . 0.0 109.818 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 30.4 m -72.34 121.47 19.53 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.391 0.615 . . . . 0.0 110.532 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -99.99 -24.37 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.92 1.288 . . . . 0.0 111.5 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -146.1 143.62 29.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.573 HG23 HG12 ' A' ' 34' ' ' VAL . 48.2 m -146.15 114.48 6.68 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.308 0.643 . . . . 0.0 109.71 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 m -69.39 164.29 23.3 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.931 0.892 . . . . 0.0 111.347 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -83.39 178.19 8.15 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.394 0.616 . . . . 0.0 111.948 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.57 113.36 11.74 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.222 -177.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.76 156.78 16.18 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.006 0.922 . . . . 0.0 109.002 171.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.7 m -82.31 -24.47 34.61 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 173.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.7 t -126.61 146.87 50.0 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.365 0.666 . . . . 0.0 111.316 -174.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.5 ' HD3' ' H ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -75.08 -27.84 60.09 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.207 176.389 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.7 m -63.49 -38.42 91.07 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.54 1.536 . . . . 0.0 110.925 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.3 m -65.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.551 0.74 . . . . 0.0 110.606 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.31 -30.81 57.87 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.158 0.983 . . . . 0.0 111.92 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -73.98 -38.08 64.26 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.516 0.726 . . . . 0.0 110.143 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -22.79 52.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.248 169.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.97 93.36 Favored Glycine 0 C--N 1.349 1.281 0 O-C-N 123.745 0.653 . . . . 0.0 112.655 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.494 ' HA ' HG22 ' A' ' 62' ' ' VAL . 5.7 tt -65.55 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 122.341 0.256 . . . . 0.0 110.37 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -35.76 81.56 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.074 0.55 . . . . 0.0 110.893 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.9 m -73.7 -43.84 58.17 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.57 0.748 . . . . 0.0 111.621 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.494 HG22 ' HA ' ' A' ' 59' ' ' ILE . 18.8 m -70.11 -29.11 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -67.89 -45.14 75.33 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.919 0.888 . . . . 0.0 108.887 176.89 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 42.6 t -64.97 -15.79 62.63 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.076 0.95 . . . . 0.0 111.892 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.99 18.47 9.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.443 0.697 . . . . 0.0 112.392 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -63.19 -45.85 85.67 Favored Pre-proline 0 CA--C 1.567 1.619 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.195 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.64 -12.81 11.03 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 121.614 1.543 . . . . 0.0 113.093 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -75.98 84.66 2.88 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.484 0.659 . . . . 0.0 110.868 -173.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.06 -28.7 70.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.147 1.379 . . . . 0.0 112.045 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -63.24 -35.82 81.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.659 0.783 . . . . 0.0 110.824 174.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.432 ' HA ' ' NE ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.19 -19.99 35.48 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.453 -174.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -70.83 106.3 3.55 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 167.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -97.63 107.4 19.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.494 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.99 123.69 43.45 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.118 0.967 . . . . 0.0 109.75 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -132.99 150.65 52.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.844 1.257 . . . . 0.0 109.633 -175.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.2 m -92.79 117.26 29.82 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.581 0.752 . . . . 0.0 109.518 171.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.86 163.53 7.46 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.078 0.951 . . . . 0.0 112.235 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -68.58 -14.68 63.18 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.269 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -82.79 1.87 36.85 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.086 0.955 . . . . 0.0 111.772 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.81 32.91 58.52 Favored Glycine 0 C--N 1.353 1.506 0 C-N-CA 123.121 0.391 . . . . 0.0 112.951 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 74.8 mmtt -122.94 150.28 43.16 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.114 0.965 . . . . 0.0 109.728 -177.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -96.57 126.82 42.02 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.307 0.643 . . . . 0.0 109.987 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -137.79 176.69 8.48 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -141.46 166.14 25.56 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.907 0.483 . . . . 0.0 110.116 173.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.421 ' N ' HD22 ' A' ' 85' ' ' ASN . 0.0 OUTLIER -148.51 135.57 20.12 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.694 HD12 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -88.51 119.41 28.93 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -93.16 139.28 30.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.318 1.047 . . . . 0.0 109.896 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.2 176.1 7.09 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.279 0.632 . . . . 0.0 110.643 177.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.63 -23.71 65.38 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 121.448 0.642 . . . . 0.0 110.126 169.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -79.56 -3.81 48.6 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.728 174.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.6 m80 65.42 15.57 10.09 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 125.737 1.615 . . . . 0.0 111.235 -175.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -88.23 154.7 20.22 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 123.703 0.801 . . . . 0.0 110.048 177.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.476 HG21 ' HB2' ' A' ' 96' ' ' SER . 13.9 mm -84.14 99.16 6.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.694 HD11 HD12 ' A' ' 86' ' ' LEU . 10.0 pt -83.6 -8.38 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 122.801 0.44 . . . . 0.0 111.82 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.76 103.85 0.19 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.802 -0.443 . . . . 0.0 112.293 176.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.476 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.6 t -100.57 119.39 38.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.805 0.842 . . . . 0.0 109.229 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.3 t -73.77 167.33 21.63 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.94 0.496 . . . . 0.0 110.8 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -85.38 166.63 16.26 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.382 0.673 . . . . 0.0 110.494 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 72.1 mtm -74.35 118.63 17.54 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.579 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -94.41 144.3 25.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.124 0.97 . . . . 0.0 109.005 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.536 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -62.25 -58.02 9.28 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.418 0.687 . . . . 0.0 110.707 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.7 p -110.73 169.15 8.95 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.022 0.929 . . . . 0.0 110.954 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.74 -30.01 65.15 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.97 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -64.41 -32.49 74.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.109 0.564 . . . . 0.0 110.971 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.4 t -79.05 -32.89 45.02 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.755 0.822 . . . . 0.0 110.426 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -69.22 -38.72 78.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.724 0.81 . . . . 0.0 111.515 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -75.61 -29.87 59.38 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 122.95 0.5 . . . . 0.0 111.281 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 47.0 m -65.83 -34.31 77.86 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.43 -46.22 93.11 Favored Glycine 0 C--N 1.351 1.372 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.153 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.0 mm -55.09 -46.84 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.54 0.736 . . . . 0.0 109.839 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.22 93.16 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.9 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.7 t -71.63 -46.57 58.66 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.205 0.602 . . . . 0.0 110.361 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 81.0 t -64.86 -30.9 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.943 0.897 . . . . 0.0 111.124 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.92 -51.5 54.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.362 0.665 . . . . 0.0 110.405 173.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.84 -20.94 55.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.802 0.841 . . . . 0.0 112.431 -172.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -112.17 -8.16 14.01 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.824 0.849 . . . . 0.0 111.051 -178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.74 -28.13 65.72 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 172.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 12.6 t -74.25 -9.36 58.53 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.0 0.92 . . . . 0.0 111.83 175.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.4 t -72.92 147.01 45.71 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.206 0.602 . . . . 0.0 109.437 176.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -131.46 25.21 4.8 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.589 0.756 . . . . 0.0 110.657 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.4 t -95.88 110.84 22.96 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 172.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.3 t -119.27 117.32 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 110.209 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -78.27 135.74 37.61 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.124 . . . . 0.0 109.182 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -89.02 107.99 19.34 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -114.76 15.39 17.52 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.657 0.783 . . . . 0.0 110.305 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.6 p . . . . . 0 N--CA 1.485 1.29 0 C-N-CA 123.431 0.692 . . . . 0.0 111.745 -175.351 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.529 0 CA-C-O 121.094 0.274 . . . . 0.0 113.751 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -165.39 155.52 13.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.296 1.038 . . . . 0.0 109.842 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' HD13 ' A' ' 35' ' ' LEU . 59.6 m-85 -97.4 148.41 23.21 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.575 0.75 . . . . 0.0 109.937 169.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -129.75 117.61 20.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.852 0.861 . . . . 0.0 108.703 170.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 31' ' ' PHE . 28.7 tp -81.63 102.45 10.68 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 175.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.1 m -106.49 162.84 13.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.217 1.007 . . . . 0.0 108.816 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -121.44 165.68 15.23 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 61.0 p -96.75 173.79 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 123.932 0.893 . . . . 0.0 110.034 176.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.1 t -67.46 -21.72 65.53 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.351 0.596 . . . . 0.0 110.244 171.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.78 -13.14 60.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.321 1.048 . . . . 0.0 111.657 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 86.0 -7.04 0.8 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 126.348 1.859 . . . . 0.0 112.4 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.642 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 8.7 mp0 -65.63 132.96 50.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.196 0.598 . . . . 0.0 110.675 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.521 ' HB3' HD11 ' A' ' 23' ' ' LEU . 83.7 m-85 -91.31 148.54 22.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.358 1.063 . . . . 0.0 110.58 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -152.59 129.9 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.433 0.693 . . . . 0.0 109.306 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -91.21 126.93 36.45 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 173.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.38 130.27 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -99.25 123.01 43.2 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 173.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -118.68 149.51 41.29 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.259 1.024 . . . . 0.0 108.901 177.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.84 -179.15 6.4 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.441 0.696 . . . . 0.0 110.242 172.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.44 -20.27 65.41 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-O 120.997 0.221 . . . . 0.0 112.99 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -78.43 -10.3 59.64 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.293 1.037 . . . . 0.0 111.186 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.81 -0.66 89.15 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 123.035 0.35 . . . . 0.0 113.067 -175.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.38 121.76 20.06 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.064 0.945 . . . . 0.0 110.132 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 m -71.39 120.2 16.63 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 35' ' ' LEU . 26.7 pt -109.98 -8.35 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.699 1.2 . . . . 0.0 111.159 -177.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 16.9 tp -164.31 151.25 11.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.153 0.581 . . . . 0.0 110.487 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 46.7 m -146.1 126.34 13.89 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.462 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 87.3 p -67.01 155.13 39.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.35 0.66 . . . . 0.0 111.031 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.86 138.39 58.14 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 10.4 mp -64.07 111.97 2.77 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.199 0.523 . . . . 0.0 110.582 -173.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.3 m-85 -82.34 147.6 28.76 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.247 1.019 . . . . 0.0 110.657 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 m -69.76 -37.24 76.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.562 0.745 . . . . 0.0 110.886 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -112.69 155.33 24.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.564 0.746 . . . . 0.0 110.848 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -62.91 -43.18 99.48 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.946 0.898 . . . . 0.0 109.14 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.5 p -61.02 -40.78 94.85 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.086 0.866 . . . . 0.0 110.917 -177.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 20.0 m -63.13 -39.97 96.23 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.613 0.765 . . . . 0.0 110.931 178.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.2 84.32 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.527 0.731 . . . . 0.0 110.992 176.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -68.66 -32.11 71.71 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.667 0.787 . . . . 0.0 111.082 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -77.82 -22.94 49.25 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.086 0.554 . . . . 0.0 110.949 171.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.57 94.83 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.819 0.699 . . . . 0.0 113.778 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.5 tt -64.16 -37.79 80.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 117.02 0.41 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.96 71.27 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.289 0.635 . . . . 0.0 110.952 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 m -73.14 -49.96 25.32 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.624 177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 59' ' ' ILE . 26.0 m -65.46 -38.8 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.538 -173.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -65.56 -32.99 74.88 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.074 0.464 . . . . 0.0 110.923 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 t -74.27 -24.53 59.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.594 0.758 . . . . 0.0 111.03 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -107.41 3.1 24.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.312 0.645 . . . . 0.0 111.469 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 75.7 m -63.76 -43.6 77.22 Favored Pre-proline 0 N--CA 1.487 1.393 0 CA-C-O 118.545 -0.741 . . . . 0.0 112.768 174.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -83.95 18.93 1.44 Allowed 'Trans proline' 0 C--N 1.38 2.222 0 CA-C-N 121.657 1.628 . . . . 0.0 113.02 175.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -118.79 96.63 5.34 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.09 0.956 . . . . 0.0 109.895 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -26.7 68.4 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.917 0.487 . . . . 0.0 110.199 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -45.88 -40.8 10.49 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.815 1.646 . . . . 0.0 112.513 171.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -90.06 -23.82 21.33 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.338 0.655 . . . . 0.0 111.253 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -70.41 118.41 13.19 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 120.649 0.262 . . . . 0.0 110.333 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -96.04 98.64 10.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -66.45 103.61 1.08 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -124.87 139.77 53.53 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.642 0.777 . . . . 0.0 109.731 -164.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -97.28 127.93 43.68 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.228 0.611 . . . . 0.0 110.083 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.28 150.67 40.1 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.887 0.875 . . . . 0.0 110.71 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 t -71.4 -8.17 52.08 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 121.313 0.578 . . . . 0.0 110.016 171.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -74.57 -3.74 32.84 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.557 1.143 . . . . 0.0 111.906 169.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.94 13.51 82.08 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 123.042 0.353 . . . . 0.0 112.625 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -110.64 178.42 4.37 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.208 1.003 . . . . 0.0 110.202 -177.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -126.3 127.77 46.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.69 0.396 . . . . 0.0 110.982 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.604 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 20.3 p90 -129.65 176.7 7.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.835 1.254 . . . . 0.0 108.688 174.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -133.54 150.35 51.67 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.768 0.318 . . . . 0.0 110.174 174.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -133.41 124.08 26.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.52 129.23 34.88 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 123.816 0.847 . . . . 0.0 109.614 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -99.82 162.01 13.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.298 1.039 . . . . 0.0 111.355 -178.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.43 179.52 4.25 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.183 -1.372 . . . . 0.0 109.413 173.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.36 -15.63 63.35 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.06 0.544 . . . . 0.0 111.128 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -96.9 16.49 19.2 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.661 0.784 . . . . 0.0 111.968 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 80.6 m80 64.24 9.5 4.86 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 124.433 1.093 . . . . 0.0 112.723 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -88.04 146.47 25.45 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.248 0.619 . . . . 0.0 110.508 -176.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.4 mt -82.88 100.57 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.9 pt -86.98 -13.1 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.829 177.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.462 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -153.11 149.83 21.47 Favored Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 176.095 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 p -158.32 128.54 6.07 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.479 0.711 . . . . 0.0 109.502 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.7 t -107.37 166.97 10.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.688 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -75.03 161.24 29.62 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.508 0.723 . . . . 0.0 110.724 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.604 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -74.7 118.67 17.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.381 0.61 . . . . 0.0 110.005 -178.804 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.51 148.44 27.21 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.316 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.33 71.79 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.956 0.902 . . . . 0.0 112.117 -177.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.3 p -128.94 162.68 27.0 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.483 0.713 . . . . 0.0 110.188 175.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -65.5 -36.09 82.81 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.139 172.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.0 -37.91 89.06 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.489 0.715 . . . . 0.0 111.503 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.0 t -67.92 -30.58 69.94 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.57 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -70.59 -38.21 74.0 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.865 0.466 . . . . 0.0 110.704 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 7.1 mm-40 -68.09 -28.9 67.74 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.127 0.571 . . . . 0.0 111.011 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.2 m -61.72 -45.95 91.75 Favored 'General case' 0 C--N 1.349 0.577 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.07 -34.84 91.01 Favored Glycine 0 C--N 1.349 1.285 0 CA-C-N 115.056 -0.974 . . . . 0.0 113.526 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 28.6 mm -60.05 -52.37 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.1 66.44 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.473 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.1 t -70.72 -50.07 40.2 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.248 0.619 . . . . 0.0 110.003 -178.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.55 -30.67 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 C-N-CA 123.504 0.721 . . . . 0.0 110.871 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 83.9 tttt -64.2 -35.02 79.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.432 0.693 . . . . 0.0 111.45 177.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -93.49 -36.17 12.58 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.663 0.785 . . . . 0.0 112.49 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -103.76 -8.56 19.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.096 0.958 . . . . 0.0 111.785 -168.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.61 -22.79 73.61 Favored Glycine 0 N--CA 1.472 1.041 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.131 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -84.06 -12.12 55.63 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.662 0.785 . . . . 0.0 111.354 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.8 m -69.42 101.59 1.59 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 109.888 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -82.86 18.95 1.45 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.272 0.629 . . . . 0.0 111.915 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.6 m -75.32 93.95 2.96 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.298 1.039 . . . . 0.0 109.353 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.62 139.32 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.662 0.785 . . . . 0.0 110.903 -172.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -118.91 115.36 24.21 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.351 1.06 . . . . 0.0 109.099 175.922 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.38 97.35 7.68 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 121.421 0.629 . . . . 0.0 111.142 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.59 -16.01 58.87 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.179 0.992 . . . . 0.0 111.312 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 CA--C 1.547 0.857 0 C-N-CA 124.553 1.141 . . . . 0.0 112.459 -175.629 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.265 0 N-CA-C 113.526 0.17 . . . . 0.0 113.526 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 38.3 p90 -119.51 160.3 22.66 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.916 0.887 . . . . 0.0 110.597 -173.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -86.95 153.31 21.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.976 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.438 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 86.6 mt-10 -132.86 121.21 22.57 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 167.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.28 98.16 5.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -99.33 163.04 12.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.84 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 17.2 ptpt -133.83 134.12 42.42 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 168.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.9 m -76.62 175.47 9.27 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.319 0.581 . . . . 0.0 110.896 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 t -67.5 -12.58 60.65 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.619 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -83.37 3.59 31.08 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.658 1.183 . . . . 0.0 112.219 175.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 m120 65.67 15.32 9.99 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.167 0.987 . . . . 0.0 111.923 -175.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HB2' HD12 ' A' ' 48' ' ' LEU . 15.0 mm100 -96.29 137.76 34.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.864 0.865 . . . . 0.0 109.914 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -90.55 144.22 25.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.034 0.534 . . . . 0.0 110.73 -175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -156.97 147.04 20.96 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 109.064 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -94.28 127.5 40.18 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.3 m -107.47 132.8 54.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.684 HD22 ' HB3' ' A' ' 116' ' ' ASN . 11.5 mt -99.24 112.24 24.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.395 0.678 . . . . 0.0 109.257 177.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -102.75 125.94 49.68 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.98 178.05 1.2 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 123.758 0.661 . . . . 0.0 111.097 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.91 -12.75 37.34 Favored Glycine 0 CA--C 1.541 1.685 0 N-CA-C 114.079 0.392 . . . . 0.0 114.079 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -85.2 -6.22 59.29 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.411 1.085 . . . . 0.0 112.017 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 14.32 81.9 Favored Glycine 0 N--CA 1.473 1.121 0 C-N-CA 122.727 0.204 . . . . 0.0 112.982 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -102.75 121.5 42.59 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.328 1.051 . . . . 0.0 109.764 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.1 m -66.21 120.97 14.17 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.074 0.55 . . . . 0.0 110.459 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.2 pt -99.93 -35.41 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 124.616 1.166 . . . . 0.0 110.366 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 20.4 tp -137.38 148.47 46.25 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.701 0.801 . . . . 0.0 109.926 -169.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.1 m -145.15 116.81 8.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.32 0.648 . . . . 0.0 109.506 175.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.5 t -65.44 157.72 28.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.087 0.955 . . . . 0.0 110.801 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.84 164.83 18.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.126 0.571 . . . . 0.0 111.153 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.5 mm? -70.65 127.92 34.33 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.167 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.452 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -107.7 142.68 37.32 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.119 0.968 . . . . 0.0 109.706 177.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.3 -22.5 63.79 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.368 0.667 . . . . 0.0 111.749 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.7 t -148.42 159.5 43.97 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.237 0.615 . . . . 0.0 111.483 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -27.96 68.3 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.786 0.835 . . . . 0.0 111.177 176.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.9 t -71.27 -32.51 68.79 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.912 0.485 . . . . 0.0 110.731 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.452 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 16.4 m -69.04 -40.87 78.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.492 0.717 . . . . 0.0 109.61 173.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.98 -31.67 72.39 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.355 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.83 -40.33 95.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.546 0.739 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -71.3 -34.37 70.55 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.525 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.45 98.29 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.637 -0.711 . . . . 0.0 113.14 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.6 tt -74.68 -37.73 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.741 0.27 . . . . 0.0 110.742 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.62 70.47 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.059 0.544 . . . . 0.0 110.267 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 m -71.53 -55.71 7.29 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.708 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 59' ' ' ILE . 33.7 m -59.61 -31.2 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-N 118.27 0.486 . . . . 0.0 111.758 -176.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -62.5 -47.85 82.12 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.54 1.136 . . . . 0.0 110.546 176.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.3 m -72.26 -26.1 61.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.025 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.496 ' ND2' ' HG2' ' A' ' 71' ' ' ARG . 4.3 m-20 -96.39 1.59 51.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.326 1.051 . . . . 0.0 111.794 -174.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.548 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 23.5 m -59.46 -50.27 88.08 Favored Pre-proline 0 CA--C 1.565 1.525 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.777 175.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -83.03 -5.78 11.29 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.824 1.682 . . . . 0.0 113.232 175.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -83.32 78.35 9.64 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.62 -30.22 71.36 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.925 0.89 . . . . 0.0 112.055 -175.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.18 -24.45 59.37 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.626 0.77 . . . . 0.0 111.195 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.496 ' HG2' ' ND2' ' A' ' 65' ' ' ASN . 3.4 tpm_? -75.79 -23.25 55.87 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.196 0.599 . . . . 0.0 110.661 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -70.55 120.56 16.36 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -101.36 108.3 19.88 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.482 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 135.58 33.49 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.665 0.386 . . . . 0.0 110.093 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -155.59 161.43 40.84 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 109.747 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.9 m -92.56 141.55 28.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.05 0.54 . . . . 0.0 109.814 176.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.69 158.0 28.45 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.712 0.805 . . . . 0.0 109.943 170.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.9 t -64.06 -23.79 67.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.307 0.643 . . . . 0.0 110.714 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -66.9 -18.44 65.38 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.876 0.871 . . . . 0.0 111.693 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.88 -7.9 42.12 Favored Glycine 0 C--N 1.349 1.271 0 C-N-CA 122.961 0.315 . . . . 0.0 113.591 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.529 ' HG3' ' HA ' ' A' ' 101' ' ' ALA . 0.0 OUTLIER -99.31 146.18 26.52 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.18 0.592 . . . . 0.0 110.734 -176.367 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -90.43 139.19 30.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.155 0.982 . . . . 0.0 110.415 -172.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -148.64 174.86 11.71 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.674 0.79 . . . . 0.0 109.268 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -131.14 138.74 49.6 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.458 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.547 HD22 HD13 ' A' ' 93' ' ' ILE . 11.5 m-20 -114.9 105.56 13.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.892 1.277 . . . . 0.0 108.904 172.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.7 OUTLIER -78.7 111.6 14.96 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 173.216 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -120.73 146.18 46.74 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 176.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.415 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -86.44 -173.88 4.74 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.443 0.697 . . . . 0.0 111.13 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.35 -28.1 67.91 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -95.9 24.42 5.49 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.096 0.558 . . . . 0.0 111.571 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.0 t60 72.3 -3.79 2.19 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -70.61 112.63 7.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.381 0.672 . . . . 0.0 109.93 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.547 HD13 HD22 ' A' ' 85' ' ' ASN . 57.0 mt -67.39 98.35 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 122.032 0.92 . . . . 0.0 109.071 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 21.3 pt -82.67 -6.68 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.144 -178.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -164.03 117.24 0.75 Allowed Glycine 0 C--N 1.345 1.034 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.5 t -116.12 114.86 25.07 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.903 0.881 . . . . 0.0 108.944 175.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.9 p -81.79 167.76 18.72 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.842 0.457 . . . . 0.0 111.283 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -77.23 164.31 25.72 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.226 177.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.8 ptp -73.58 123.5 24.1 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -102.31 122.08 43.54 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.77 0.828 . . . . 0.0 109.773 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.529 ' HA ' ' HG3' ' A' ' 81' ' ' LYS . . . -62.79 -40.72 98.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.816 0.846 . . . . 0.0 110.845 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.462 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 39.1 p -104.87 131.3 52.53 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.21 65.35 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.306 1.042 . . . . 0.0 111.828 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.462 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 10.8 pt20 -62.93 -37.43 87.0 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.024 0.53 . . . . 0.0 110.737 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 13.9 t -71.31 -28.53 64.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.383 0.673 . . . . 0.0 110.515 -177.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -67.36 -51.2 55.1 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.105 0.962 . . . . 0.0 109.87 177.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.96 -29.09 60.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.095 0.558 . . . . 0.0 111.948 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 98.0 m -67.57 -33.51 75.17 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.2 -30.12 76.56 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.171 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.3 mm -64.96 -49.39 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-O 121.368 0.604 . . . . 0.0 109.886 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.91 73.08 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.198 178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.2 t -71.13 -48.65 50.89 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.16 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.19 -27.12 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.448 0.699 . . . . 0.0 110.724 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 38.8 ttpt -66.59 -46.75 74.92 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 172.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.58 -33.66 69.24 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.906 0.883 . . . . 0.0 111.92 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.684 ' HB3' HD22 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -84.39 -30.99 24.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 0.0 110.01 -177.158 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.54 -41.17 58.27 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.5 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.1 p -80.47 -4.71 54.84 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.446 0.698 . . . . 0.0 111.713 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.8 t -75.77 -34.33 60.24 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.992 0.517 . . . . 0.0 109.835 173.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 67.75 -7.64 0.58 Allowed 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 125.37 1.468 . . . . 0.0 114.261 167.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 t -80.31 123.98 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.229 0.612 . . . . 0.0 110.768 -170.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 57.6 t -105.52 133.95 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 123.35 0.66 . . . . 0.0 111.303 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.438 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 43.1 tptt -110.45 141.76 43.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.11 1.364 . . . . 0.0 108.411 173.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -84.24 112.4 20.25 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -110.7 11.59 22.67 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.891 0.853 . . . . 0.0 109.687 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.455 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 21.7 p . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 124.255 1.022 . . . . 0.0 110.82 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.522 0.487 0 N-CA-C 114.011 0.364 . . . . 0.0 114.011 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -152.2 169.87 21.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.844 0.858 . . . . 0.0 109.958 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -109.98 127.15 54.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.347 1.059 . . . . 0.0 109.568 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -91.97 106.87 18.8 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 167.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 64.6 tp -85.52 98.5 10.66 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 176.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -113.37 177.92 4.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.937 0.895 . . . . 0.0 109.735 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -141.75 156.0 45.61 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.626 0.77 . . . . 0.0 109.935 175.658 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.6 m -89.86 178.69 6.17 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.126 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -66.65 -22.85 66.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.616 0.766 . . . . 0.0 110.801 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -91.11 15.36 11.86 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.415 0.686 . . . . 0.0 111.285 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 67.3 14.96 9.87 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.243 1.417 . . . . 0.0 112.75 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 16.0 mm100 -70.32 124.86 25.2 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.67 0.788 . . . . 0.0 110.997 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.84 118.68 24.64 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.809 0.844 . . . . 0.0 108.942 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -142.49 118.99 10.95 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.92 0.888 . . . . 0.0 109.093 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -94.04 132.03 38.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.603 HG12 HG23 ' A' ' 45' ' ' THR . 23.2 m -107.45 133.97 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 171.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.9 tp -90.0 120.79 31.51 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -106.8 153.95 21.72 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.692 1.197 . . . . 0.0 109.653 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.19 177.66 8.88 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.775 168.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.34 -23.53 62.43 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.449 173.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -67.35 -18.89 65.33 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.766 1.227 . . . . 0.0 111.769 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.89 -7.82 80.66 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.796 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.05 136.23 36.53 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.286 0.634 . . . . 0.0 109.712 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.0 m -73.15 120.84 19.33 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.342 0.591 . . . . 0.0 109.779 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.534 HD11 ' HG ' ' A' ' 35' ' ' LEU . 22.0 pt -103.74 -16.52 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.606 1.162 . . . . 0.0 111.245 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.7 tp -157.8 141.7 15.79 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.603 HG23 HG12 ' A' ' 34' ' ' VAL . 53.3 m -133.16 113.45 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.242 0.617 . . . . 0.0 109.652 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -69.5 164.82 22.3 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.964 0.506 . . . . 0.0 110.799 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -75.92 166.01 24.14 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.399 0.619 . . . . 0.0 111.601 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.86 114.18 15.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.642 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -100.37 145.57 28.02 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.587 0.755 . . . . 0.0 109.17 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -90.15 -2.13 58.03 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 120.988 0.423 . . . . 0.0 111.099 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.439 ' HB3' HG22 ' A' ' 53' ' ' THR . 50.8 m -142.03 137.25 30.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.507 0.723 . . . . 0.0 110.549 -177.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -28.24 69.78 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.939 0.895 . . . . 0.0 111.64 178.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.439 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -63.22 -33.72 76.11 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.459 0.704 . . . . 0.0 111.156 178.022 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 m -76.56 -31.65 57.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.632 0.773 . . . . 0.0 110.466 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.19 -32.39 66.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.507 0.723 . . . . 0.0 110.752 173.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -67.4 -49.11 65.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.959 0.904 . . . . 0.0 110.37 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.63 -36.57 84.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.617 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.6 -48.51 85.84 Favored Glycine 0 C--N 1.345 1.049 0 O-C-N 124.124 0.89 . . . . 0.0 112.563 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.544 ' HA ' HG22 ' A' ' 62' ' ' VAL . 15.9 tt -74.64 -31.48 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 116.608 0.204 . . . . 0.0 111.146 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.68 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.972 0.509 . . . . 0.0 110.331 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.0 m -73.37 -47.71 40.0 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.13 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -62.3 -35.29 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 118.654 0.661 . . . . 0.0 110.741 -177.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.713 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 12.2 ttp180 -66.25 -45.52 80.31 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.173 0.989 . . . . 0.0 110.357 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -67.92 -28.37 67.43 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.784 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.487 ' HB3' HD11 ' A' ' 86' ' ' LEU . 16.0 m120 -100.94 3.53 41.77 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.135 0.974 . . . . 0.0 111.777 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.0 m -63.11 -52.25 63.92 Favored Pre-proline 0 CA--C 1.56 1.346 0 CA-C-O 118.648 -0.691 . . . . 0.0 110.831 172.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.49 -19.46 42.82 Favored 'Trans proline' 0 C--N 1.4 3.238 0 C-N-CA 121.642 1.561 . . . . 0.0 111.65 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 -81.73 77.21 8.6 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 121.944 0.878 . . . . 0.0 109.542 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -66.95 -21.17 65.99 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.166 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -74.43 -31.69 62.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.717 0.807 . . . . 0.0 110.603 174.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -76.51 -25.5 54.25 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.324 0.65 . . . . 0.0 111.74 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.654 ' HE1' HG23 ' A' ' 110' ' ' ILE . 8.3 p90 -107.53 132.96 52.68 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 121.133 0.492 . . . . 0.0 110.407 172.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -97.31 117.11 30.79 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.064 -174.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB2' ' HD2' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -71.77 104.08 3.31 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.214 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -119.71 151.73 38.29 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.23 1.012 . . . . 0.0 110.6 -169.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.0 m -106.17 124.64 49.91 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.351 0.66 . . . . 0.0 109.755 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 166.24 16.83 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.487 1.115 . . . . 0.0 112.046 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.9 p -64.87 -16.9 63.78 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.06 0.944 . . . . 0.0 112.112 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -90.36 9.71 27.86 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.056 0.943 . . . . 0.0 110.999 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.44 6.85 71.62 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 123.026 0.345 . . . . 0.0 113.758 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 48.2 mmtm -88.98 152.26 21.81 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.069 0.948 . . . . 0.0 110.499 -177.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.43 ' HB3' ' HB2' ' A' ' 106' ' ' ARG . 89.4 m-85 -109.74 126.52 53.82 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.378 0.671 . . . . 0.0 111.017 -170.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.667 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 16.5 p90 -143.97 178.85 7.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.68 1.192 . . . . 0.0 108.538 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.504 ' HE2' HG21 ' A' ' 113' ' ' VAL . 19.6 p90 -146.26 135.08 22.38 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.6 p-10 -116.04 146.12 42.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.487 HD11 ' HB3' ' A' ' 65' ' ' ASN . 25.3 tp -119.08 120.35 36.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.667 0.787 . . . . 0.0 109.982 -173.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -91.89 149.96 21.29 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.487 1.115 . . . . 0.0 110.985 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -107.69 176.15 5.25 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.354 1.062 . . . . 0.0 109.554 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.55 -28.2 66.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.56 0.744 . . . . 0.0 111.632 175.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -81.41 5.88 16.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.6 m80 66.24 13.12 9.01 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.685 1.194 . . . . 0.0 111.916 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.77 153.42 17.77 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 124.042 0.937 . . . . 0.0 109.874 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.5 mm -81.85 119.02 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.2 pt -98.17 -8.98 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.187 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.92 111.36 0.33 Allowed Glycine 0 C--N 1.347 1.159 0 O-C-N 123.452 0.47 . . . . 0.0 112.344 175.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 p -114.91 131.6 56.82 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.1 t -85.97 158.19 19.94 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 123.175 0.59 . . . . 0.0 110.261 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -78.41 149.08 33.39 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.667 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.0 ptt? -74.06 117.32 15.72 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.23 0.538 . . . . 0.0 110.662 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -89.45 160.08 16.96 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.602 1.161 . . . . 0.0 111.283 -176.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.448 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -75.84 -52.44 10.36 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.063 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 67.9 p -85.37 142.77 29.06 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.467 -171.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.48 -25.77 64.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.949 0.9 . . . . 0.0 111.191 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -68.56 -36.36 78.66 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 122.98 0.512 . . . . 0.0 110.505 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.2 t -67.96 -23.2 65.02 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.858 0.863 . . . . 0.0 111.309 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.478 ' O ' HG12 ' A' ' 110' ' ' ILE . 55.7 ttp180 -61.28 -56.84 15.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.365 0.666 . . . . 0.0 109.547 172.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -72.94 -32.97 65.64 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.901 0.88 . . . . 0.0 111.753 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.9 m -67.28 -36.09 80.85 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.42 -35.84 63.15 Favored Glycine 0 C--N 1.347 1.187 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.04 176.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.654 HG23 ' HE1' ' A' ' 72' ' ' TYR . 45.4 mm -57.06 -46.9 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.4 0.68 . . . . 0.0 109.419 172.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.95 -37.06 78.62 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.232 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t -67.26 -51.92 47.1 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.059 -174.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.504 HG21 ' HE2' ' A' ' 84' ' ' PHE . 79.6 t -64.9 -31.98 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 123.24 0.616 . . . . 0.0 111.27 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.87 -39.38 94.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.502 0.721 . . . . 0.0 112.026 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -92.51 -43.82 8.96 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.313 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.473 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 10.7 m120 -83.98 -18.94 35.5 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.997 0.919 . . . . 0.0 111.746 -171.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.8 -27.75 64.25 Favored Glycine 0 C--N 1.341 0.808 0 O-C-N 123.168 0.292 . . . . 0.0 112.886 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 48.1 p -75.17 -7.83 54.9 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 87.7 p -68.98 -44.22 73.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.379 0.672 . . . . 0.0 111.308 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.471 ' HB2' ' HD3' ' A' ' 63' ' ' ARG . 43.6 tt0 61.9 13.78 5.82 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.028 1.331 . . . . 0.0 111.947 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 m -81.46 89.2 6.13 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.672 -0.643 . . . . 0.0 111.107 -169.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 10.4 m -85.48 112.3 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-O 121.601 0.715 . . . . 0.0 111.728 -176.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -83.03 102.78 11.99 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 164.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -72.04 95.31 1.59 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.464 1.126 . . . . 0.0 109.826 -177.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.7 6.31 44.55 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.604 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 p . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 124.592 1.157 . . . . 0.0 110.817 173.625 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.708 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -159.75 164.67 33.64 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.913 0.885 . . . . 0.0 110.272 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -104.47 154.41 19.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.024 0.93 . . . . 0.0 109.643 172.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.8 mt-10 -136.39 117.89 14.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.084 0.954 . . . . 0.0 109.238 169.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.567 HD21 ' HB2' ' A' ' 52' ' ' LYS . 64.2 tp -81.0 107.1 13.52 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 175.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.9 p -126.85 136.66 52.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.502 0.721 . . . . 0.0 110.946 -170.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -94.66 137.71 33.42 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.696 0.798 . . . . 0.0 108.855 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -93.91 -176.51 4.05 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.766 0.826 . . . . 0.0 111.432 -177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -67.6 -16.33 64.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.029 0.532 . . . . 0.0 110.559 174.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -68.85 -12.78 61.91 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.161 0.984 . . . . 0.0 112.072 174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 69.87 13.26 8.0 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.603 1.161 . . . . 0.0 110.493 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.541 ' HB2' HD12 ' A' ' 48' ' ' LEU . 14.7 mm-40 -108.22 150.62 27.03 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.111 0.964 . . . . 0.0 110.123 -176.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -100.88 128.92 46.71 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.027 0.931 . . . . 0.0 110.585 -169.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.0 ptt85 -143.79 139.63 29.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.617 0.767 . . . . 0.0 109.056 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -94.97 137.09 34.48 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.87 132.33 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 175.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -97.97 114.94 27.19 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -103.69 153.16 20.97 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.597 1.159 . . . . 0.0 110.375 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.8 -175.36 4.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.318 1.047 . . . . 0.0 110.234 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.56 -29.77 72.76 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 113.96 0.344 . . . . 0.0 113.96 -178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -72.58 -21.32 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.026 0.93 . . . . 0.0 111.086 176.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 7.5 59.5 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.204 -173.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -81.39 121.84 26.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.627 0.771 . . . . 0.0 109.748 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 m -70.08 121.64 17.86 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 122.914 0.485 . . . . 0.0 109.905 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.8 pt -100.06 -23.43 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.892 1.277 . . . . 0.0 110.74 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 18.8 tp -145.55 139.64 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.59 0.756 . . . . 0.0 109.574 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.3 m -135.91 125.2 24.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.508 0.723 . . . . 0.0 109.158 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -78.85 170.31 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.554 0.342 . . . . 0.0 110.99 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -74.38 161.64 29.65 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.522 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.8 mm? -68.75 111.6 4.96 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.038 174.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' A' ' 94' ' ' ILE . 79.3 m-85 -98.1 151.08 20.75 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.869 0.867 . . . . 0.0 109.992 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.35 -22.47 63.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.357 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.3 t -142.54 153.2 43.36 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.382 0.673 . . . . 0.0 110.705 -176.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HB2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -69.27 -27.22 65.23 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.654 175.451 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.7 p -60.81 -40.28 92.15 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.824 0.703 . . . . 0.0 110.659 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -65.43 -33.83 76.88 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.241 1.016 . . . . 0.0 111.347 177.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.24 -29.18 60.16 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.218 0.607 . . . . 0.0 111.402 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -74.32 -33.51 63.2 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.624 0.77 . . . . 0.0 110.24 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.5 -34.22 75.51 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.477 169.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -49.87 73.86 Favored Glycine 0 C--N 1.349 1.271 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.714 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.488 ' HA ' HG22 ' A' ' 62' ' ' VAL . 8.0 tt -69.07 -35.56 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 117.037 0.419 . . . . 0.0 110.903 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -36.29 74.66 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.211 0.529 . . . . 0.0 110.289 175.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.9 m -75.76 -44.43 41.63 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.593 177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.9 m -62.95 -32.42 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-N 119.381 0.991 . . . . 0.0 110.299 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.806 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -68.03 -50.58 54.47 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.383 1.073 . . . . 0.0 109.084 177.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.2 t -63.75 -31.52 72.73 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.093 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -107.5 16.57 23.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.133 0.973 . . . . 0.0 111.898 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -60.13 -52.68 71.64 Favored Pre-proline 0 CA--C 1.566 1.573 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.041 169.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -77.31 -6.13 16.2 Favored 'Trans proline' 0 C--N 1.399 3.226 0 C-N-CA 121.91 1.74 . . . . 0.0 112.435 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -96.22 82.33 3.43 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.69 -24.24 67.54 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.881 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -59.66 -29.99 68.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.885 0.874 . . . . 0.0 111.41 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -24.04 53.78 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.197 0.599 . . . . 0.0 111.384 -175.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -80.41 105.54 11.74 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -96.8 108.9 21.65 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.14 0.576 . . . . 0.0 109.856 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -78.26 117.55 19.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.387 0.675 . . . . 0.0 109.888 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -119.73 142.29 48.66 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.98 0.912 . . . . 0.0 110.398 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.4 m -94.76 111.29 23.08 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.22 154.62 12.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.236 1.014 . . . . 0.0 112.057 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.1 t -63.0 -17.45 62.18 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.024 0.93 . . . . 0.0 111.164 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.38 3.99 11.92 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.709 1.203 . . . . 0.0 111.839 174.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.77 0.06 87.31 Favored Glycine 0 C--N 1.354 1.535 0 C-N-CA 123.276 0.465 . . . . 0.0 112.778 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -87.73 165.29 15.47 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.029 0.931 . . . . 0.0 111.266 -172.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -113.82 129.17 56.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.366 0.666 . . . . 0.0 110.103 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -143.63 176.51 9.16 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.5 p90 -141.87 138.07 31.86 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 122.745 0.418 . . . . 0.0 110.212 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -99.31 166.94 10.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 169.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.621 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -135.1 121.3 20.15 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 -176.255 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -95.53 173.61 7.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.268 0.627 . . . . 0.0 111.864 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -135.87 174.28 10.79 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.67 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.26 -28.4 69.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.021 0.928 . . . . 0.0 111.386 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -85.97 6.9 26.57 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.556 0.742 . . . . 0.0 111.139 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 69.75 7.21 6.11 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.533 1.133 . . . . 0.0 111.606 -178.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.85 143.1 30.13 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.429 0.692 . . . . 0.0 110.678 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.8 mt -80.5 109.93 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.621 HD11 HD22 ' A' ' 86' ' ' LEU . 23.8 pt -91.42 -1.61 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 124.059 0.944 . . . . 0.0 112.26 -177.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.42 147.76 9.41 Favored Glycine 0 C--O 1.221 -0.695 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.6 p -154.81 129.07 8.98 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.675 0.79 . . . . 0.0 109.198 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.4 t -81.89 161.65 23.06 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -83.78 -78.43 0.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.796 0.438 . . . . 0.0 110.5 -171.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -168.22 121.67 0.89 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.225 0.61 . . . . 0.0 109.806 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -104.02 127.63 51.58 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.598 0.759 . . . . 0.0 109.68 173.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.37 -57.12 7.18 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.223 0.609 . . . . 0.0 109.702 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.498 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 38.8 p -85.5 125.57 33.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.703 174.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.7 -16.1 63.97 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.595 0.758 . . . . 0.0 112.276 -176.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.498 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 12.7 pt20 -65.17 -31.22 72.29 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.438 0.695 . . . . 0.0 110.977 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 m -72.79 -23.38 60.79 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.649 0.78 . . . . 0.0 111.085 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 110' ' ' ILE . 6.3 tmm_? -71.85 -40.72 68.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.66 0.784 . . . . 0.0 108.97 173.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.53 -50.49 71.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.805 0.842 . . . . 0.0 110.596 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.8 m -65.49 -29.97 70.68 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.208 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.9 -44.79 95.54 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.402 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 106' ' ' ARG . 37.3 mm -56.43 -49.18 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.401 0.68 . . . . 0.0 109.791 176.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.43 -36.25 82.34 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.793 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -72.1 -42.21 66.39 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.693 0.797 . . . . 0.0 110.52 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 71.0 t -70.19 -32.8 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.605 0.762 . . . . 0.0 110.76 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -67.46 -43.14 81.81 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.114 0.565 . . . . 0.0 110.572 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.15 -45.37 66.93 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.929 0.892 . . . . 0.0 111.47 -177.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.468 ' HB3' HD11 ' A' ' 35' ' ' LEU . 58.6 m-80 -93.88 -1.85 54.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.2 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.62 -29.62 65.37 Favored Glycine 0 C--N 1.343 0.922 0 N-CA-C 111.996 -0.441 . . . . 0.0 111.996 174.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.806 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 14.7 t -88.63 5.71 41.71 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.803 0.841 . . . . 0.0 111.664 177.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.4 m -82.59 109.28 16.64 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.109 0.564 . . . . 0.0 109.695 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -86.5 74.63 9.88 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 122.031 0.92 . . . . 0.0 108.781 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.0 m -147.12 94.72 2.45 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.094 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 m -105.28 140.32 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.514 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 28.9 mtmm -107.76 117.63 34.62 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 170.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.83 94.59 1.06 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 175.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.42 -18.8 40.6 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.678 178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.549 0.937 0 C-N-CA 124.335 1.054 . . . . 0.0 110.827 174.865 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.569 0 N-CA-C 111.99 -0.444 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -130.94 151.32 51.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.526 0.73 . . . . 0.0 110.742 -175.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -90.26 155.02 19.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.543 168.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.592 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 41.3 mt-10 -132.46 124.5 28.7 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 31' ' ' PHE . 37.4 tp -79.7 99.5 7.44 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 p -106.57 156.85 18.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.28 1.432 . . . . 0.0 109.139 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.519 ' HB3' HG22 ' A' ' 126' ' ' THR . 21.6 ptmt -118.31 160.81 20.98 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.511 0.725 . . . . 0.0 109.869 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.3 t -120.39 177.81 4.89 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.457 0.703 . . . . 0.0 109.457 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -71.68 -8.52 54.65 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.142 0.577 . . . . 0.0 111.1 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.73 -4.2 33.06 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.201 1.0 . . . . 0.0 111.589 170.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 77.69 -12.94 1.01 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 125.614 1.565 . . . . 0.0 110.724 -178.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -83.5 156.62 22.75 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.218 1.007 . . . . 0.0 112.111 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.517 ' HB3' HD11 ' A' ' 23' ' ' LEU . 27.0 m-85 -97.7 151.55 20.02 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.172 -175.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -156.95 155.88 32.08 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.627 0.771 . . . . 0.0 109.442 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -102.3 131.53 48.82 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.017 0.527 . . . . 0.0 109.767 173.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.56 130.55 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.37 108.75 21.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -177.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -97.87 130.69 44.76 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.84 178.06 1.47 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.182 0.593 . . . . 0.0 110.806 172.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.58 -18.14 55.41 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-O 121.025 0.236 . . . . 0.0 113.261 174.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -74.21 -14.38 60.93 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 111.578 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.35 12.75 80.08 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.649 -172.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -98.38 124.31 42.98 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.529 0.732 . . . . 0.0 110.568 -175.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.6 m -70.48 121.51 17.91 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.1 pt -109.44 -34.75 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.038 0.935 . . . . 0.0 110.499 -178.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.7 tp -137.02 151.2 48.69 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -145.98 112.99 6.1 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.414 0.686 . . . . 0.0 110.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.4 m -58.39 156.18 10.65 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.983 0.913 . . . . 0.0 111.178 173.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.457 ' CG ' ' HB ' ' A' ' 93' ' ' ILE . 23.1 mm-40 -66.91 169.22 8.5 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.266 0.555 . . . . 0.0 111.917 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.34 111.95 11.14 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.612 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.483 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 63.8 m-85 -104.7 132.92 50.37 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.58 1.552 . . . . 0.0 109.31 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.6 p -62.07 -34.73 76.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.145 0.978 . . . . 0.0 111.589 -175.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m -122.45 152.82 39.88 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.57 1.148 . . . . 0.0 109.563 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -27.3 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.809 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.8 t -72.09 -28.23 63.16 Favored 'General case' 0 C--N 1.36 1.048 0 O-C-N 123.56 0.538 . . . . 0.0 111.35 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.483 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.3 m -71.38 -33.07 69.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.424 0.63 . . . . 0.0 109.79 174.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.21 -34.24 59.26 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.649 172.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -67.4 -42.69 82.9 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.423 1.089 . . . . 0.0 110.918 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.085 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.68 -49.84 74.17 Favored Glycine 0 C--N 1.356 1.662 0 O-C-N 123.987 0.805 . . . . 0.0 112.695 177.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -70.23 -35.86 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 122.196 0.198 . . . . 0.0 111.066 177.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.64 75.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.856 0.462 . . . . 0.0 110.746 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.9 m -76.0 -41.4 51.25 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.858 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -66.03 -30.82 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-N 119.028 0.831 . . . . 0.0 110.355 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -64.07 -39.63 94.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.139 1.375 . . . . 0.0 111.091 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 t -89.25 -28.49 19.89 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.315 0.646 . . . . 0.0 111.314 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -97.22 3.39 51.44 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.181 0.592 . . . . 0.0 112.076 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.643 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 11.7 p -69.43 -40.66 15.1 Favored Pre-proline 0 CA--C 1.568 1.66 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.854 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.48 -39.32 28.98 Favored 'Trans proline' 0 C--N 1.402 3.347 0 CA-C-N 121.484 1.566 . . . . 0.0 111.384 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -79.97 80.52 6.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.928 0.891 . . . . 0.0 110.235 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 12.4 pt-20 -68.13 -8.17 36.09 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.314 0.578 . . . . 0.0 111.868 174.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.64 -35.82 22.53 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.949 1.7 . . . . 0.0 112.217 165.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -85.28 -8.72 58.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.554 0.742 . . . . 0.0 112.41 -172.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -88.15 123.37 32.73 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.827 0.851 . . . . 0.0 109.179 177.704 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.7 96.79 9.23 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 170.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -85.58 121.53 28.4 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.556 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -145.23 142.5 29.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.457 0.703 . . . . 0.0 109.983 -173.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.6 m -99.82 130.05 45.98 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.145 0.578 . . . . 0.0 109.527 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.25 170.27 10.55 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.68 1.192 . . . . 0.0 111.845 178.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 m -64.55 -30.06 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.717 0.807 . . . . 0.0 111.464 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -72.77 -11.69 60.71 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.331 0.653 . . . . 0.0 112.146 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.17 18.4 53.56 Favored Glycine 0 C--N 1.344 0.996 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.558 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.5 mmtp -84.88 121.82 28.29 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.309 0.644 . . . . 0.0 110.222 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 100' ' ' TYR . 73.8 m-85 -80.76 133.96 35.74 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.431 0.692 . . . . 0.0 109.76 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -152.22 173.66 14.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.458 0.647 . . . . 0.0 110.202 173.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -147.16 142.57 27.46 Favored 'General case' 0 C--O 1.246 0.912 0 C-N-CA 124.89 1.276 . . . . 0.0 108.213 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -117.18 110.6 18.35 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 174.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.677 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -77.9 128.03 33.3 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 178.759 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.592 ' HE2' HG12 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -113.55 145.45 41.21 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.788 0.835 . . . . 0.0 110.126 -171.122 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.79 170.64 10.25 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.958 0.903 . . . . 0.0 109.613 171.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.98 61.27 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.156 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.13 2.56 56.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.092 0.957 . . . . 0.0 111.512 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 67.8 17.58 9.74 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.797 1.239 . . . . 0.0 112.439 -175.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -79.34 126.65 31.08 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.592 HG12 ' HE2' ' A' ' 87' ' ' LYS . 39.8 mt -73.58 96.87 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.677 HD11 HD22 ' A' ' 86' ' ' LEU . 13.9 pt -79.95 -13.33 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.86 -175.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -158.73 129.91 2.38 Favored Glycine 0 C--O 1.218 -0.853 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 173.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.3 t -134.2 112.43 11.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.8 p -71.0 140.42 50.81 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -77.12 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 124.277 0.986 . . . . 0.0 110.11 -168.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 20.8 ptp -171.61 134.67 0.84 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.258 1.023 . . . . 0.0 108.732 168.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.466 ' HB2' ' HB2' ' A' ' 82' ' ' PHE . 24.0 m-85 -105.13 136.65 44.24 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.062 0.945 . . . . 0.0 110.258 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -92.33 -24.83 18.8 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.114 0.566 . . . . 0.0 110.618 174.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.468 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 74.0 p -115.07 132.53 56.57 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.66 0.784 . . . . 0.0 110.049 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.05 -20.28 29.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.578 0.751 . . . . 0.0 110.941 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.468 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 14.0 pt20 -67.23 -33.77 76.07 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.861 0.864 . . . . 0.0 111.886 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.518 ' HB2' ' NH1' ' A' ' 106' ' ' ARG . 20.6 m -72.88 -18.46 61.42 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.111 0.564 . . . . 0.0 111.71 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.518 ' NH1' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER -59.99 -26.93 66.44 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.342 1.057 . . . . 0.0 112.473 178.416 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.5 -49.4 77.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.521 0.728 . . . . 0.0 110.472 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.5 m -76.23 -35.02 59.21 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.852 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.466 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -64.57 -51.94 47.55 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.874 -173.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.3 mm -59.17 -41.65 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 123.919 0.888 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.11 90.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.107 0.563 . . . . 0.0 110.967 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.3 t -73.77 -30.26 62.67 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.43 0.692 . . . . 0.0 111.721 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 109' ' ' GLY . 79.5 t -74.22 -35.5 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 122.567 0.347 . . . . 0.0 110.102 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 66' ' ' SER . 68.7 mttm -70.65 -48.1 56.63 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.474 0.31 . . . . 0.0 111.089 174.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.49 -51.14 31.05 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.59 0.756 . . . . 0.0 111.967 -174.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -95.92 -7.47 36.57 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.182 0.593 . . . . 0.0 111.483 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.27 -21.08 71.02 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.084 0.24 . . . . 0.0 112.873 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.9 p -81.74 -1.45 47.13 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.372 0.669 . . . . 0.0 111.748 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.2 m -75.25 135.48 40.97 Favored 'General case' 0 C--N 1.348 0.541 0 C-N-CA 122.711 0.404 . . . . 0.0 110.941 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -3.28 58.07 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.306 0.642 . . . . 0.0 110.47 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 35.3 m -65.86 101.93 0.71 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.215 1.006 . . . . 0.0 110.847 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 16.0 m -117.91 142.12 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.592 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 14.2 tmtt? -122.09 139.69 53.41 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.01 124.09 27.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.394 0.616 . . . . 0.0 111.659 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -132.63 -18.8 2.42 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.614 0.766 . . . . 0.0 109.944 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.519 HG22 ' HB3' ' A' ' 25' ' ' LYS . 8.4 p . . . . . 0 C--N 1.36 1.062 0 C-N-CA 124.659 1.184 . . . . 0.0 111.004 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.513 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . . . . . . 0 C--O 1.236 0.271 0 N-CA-C 113.326 0.09 . . . . 0.0 113.326 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 31.7 p90 -137.49 148.65 46.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.063 0.945 . . . . 0.0 110.058 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -91.67 147.23 23.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.208 1.003 . . . . 0.0 108.859 170.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.549 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 42.9 mt-10 -133.75 116.37 15.67 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.471 0.709 . . . . 0.0 109.446 175.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' A' ' 31' ' ' PHE . 32.6 tp -83.25 99.51 10.02 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.381 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.9 p -108.84 147.59 31.88 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.329 1.052 . . . . 0.0 109.31 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' HG3' HG22 ' A' ' 126' ' ' THR . 9.9 mtmp? -95.78 143.69 26.8 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 173.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.5 p -86.73 -172.34 3.96 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.209 1.003 . . . . 0.0 111.159 -176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.27 -19.85 64.74 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 122.803 0.441 . . . . 0.0 110.437 171.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -84.11 -1.09 54.32 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.016 0.927 . . . . 0.0 111.948 174.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.5 t30 69.96 9.77 7.22 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 124.73 1.212 . . . . 0.0 110.702 -175.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -88.3 154.4 20.44 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.589 0.756 . . . . 0.0 111.448 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.581 ' HB3' HD11 ' A' ' 23' ' ' LEU . 94.4 m-85 -89.79 125.15 35.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.247 1.019 . . . . 0.0 110.568 -171.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -137.56 130.33 30.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.922 1.289 . . . . 0.0 108.936 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -91.3 132.48 36.12 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.138 0.575 . . . . 0.0 109.638 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.49 HG12 HG23 ' A' ' 45' ' ' THR . 25.8 m -113.71 131.05 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 167.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 26.0 tp -101.7 110.26 22.21 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 177.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 61.2 mttp -100.4 143.17 30.9 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.849 0.86 . . . . 0.0 108.89 172.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.26 173.44 4.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.209 0.604 . . . . 0.0 110.144 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.15 -19.04 61.16 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.638 -0.255 . . . . 0.0 112.992 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.04 -4.08 39.37 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.295 1.038 . . . . 0.0 112.362 175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.42 4.25 89.03 Favored Glycine 0 C--N 1.348 1.232 0 CA-C-O 120.891 0.162 . . . . 0.0 112.842 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -90.19 113.29 25.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.439 1.096 . . . . 0.0 109.24 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 22.1 m -61.84 129.52 41.34 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 122.837 0.455 . . . . 0.0 109.821 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.5 pt -115.8 -22.12 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 124.426 1.091 . . . . 0.0 110.581 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.4 tp -150.97 143.77 24.49 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.335 1.054 . . . . 0.0 108.319 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.49 HG23 HG12 ' A' ' 34' ' ' VAL . 96.3 m -139.55 112.15 7.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.6 0.76 . . . . 0.0 109.235 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.4 t -68.68 166.1 18.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.857 0.863 . . . . 0.0 110.542 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -89.27 -172.51 3.66 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.82 119.66 26.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.76 0.824 . . . . 0.0 110.984 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.0 m-85 -109.19 133.18 53.36 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.014 0.925 . . . . 0.0 108.95 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 70.3 p -61.04 -41.27 96.26 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.114 0.566 . . . . 0.0 110.972 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -119.73 148.48 43.36 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.321 1.048 . . . . 0.0 109.738 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 16.4 ptpt -68.31 -27.03 65.93 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.433 0.293 . . . . 0.0 110.948 177.347 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.1 p -55.71 -37.63 68.66 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.737 0.815 . . . . 0.0 111.311 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 12.6 m -70.29 -38.92 75.11 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.907 0.883 . . . . 0.0 110.448 174.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.59 -28.53 67.84 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.471 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 52' ' ' LYS . 67.3 mm-40 -68.35 -38.89 81.9 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.239 0.616 . . . . 0.0 109.916 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 -31.67 70.72 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.294 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -65.34 -49.15 62.69 Favored Glycine 0 C--N 1.344 0.99 0 O-C-N 123.975 0.797 . . . . 0.0 113.061 177.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.405 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.3 tt -72.52 -31.88 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 122.672 0.389 . . . . 0.0 110.977 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.9 85.4 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.673 0.389 . . . . 0.0 110.129 173.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.7 m -69.81 -47.15 63.88 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.836 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' GLY . 15.1 m -61.79 -34.22 61.44 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 CA-C-N 119.146 0.885 . . . . 0.0 111.618 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.29 -33.41 49.44 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 123.299 0.639 . . . . 0.0 109.727 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.7 t -75.18 -26.29 58.93 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.823 0.849 . . . . 0.0 111.097 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.18 0.63 43.76 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.266 1.026 . . . . 0.0 110.993 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.7 t -67.34 -40.0 24.1 Favored Pre-proline 0 CA--C 1.566 1.576 0 C-N-CA 123.007 0.523 . . . . 0.0 111.837 175.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -72.38 -23.85 20.06 Favored 'Trans proline' 0 C--N 1.39 2.723 0 C-N-CA 121.756 1.637 . . . . 0.0 113.229 166.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -79.94 90.87 5.36 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.914 0.485 . . . . 0.0 110.356 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 72' ' ' TYR . 11.6 pt-20 -64.93 -24.17 67.44 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.015 0.926 . . . . 0.0 111.776 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.29 -14.47 62.61 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.978 0.911 . . . . 0.0 112.557 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.436 ' HA ' ' HE ' ' A' ' 71' ' ' ARG . 7.7 mmp_? -91.14 -24.04 20.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.769 0.428 . . . . 0.0 110.762 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.422 ' HD2' ' HA ' ' A' ' 69' ' ' GLU . 89.6 m-85 -75.46 95.78 3.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.614 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -96.12 106.18 18.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.705 0.802 . . . . 0.0 109.857 -174.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.471 ' HB3' ' NE ' ' A' ' 106' ' ' ARG . 62.4 pttt -91.19 123.41 34.62 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.185 0.517 . . . . 0.0 111.223 -177.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.63 168.97 16.25 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.738 0.815 . . . . 0.0 109.494 175.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 7.4 m -100.4 112.65 25.02 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.23 163.05 1.23 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.464 1.106 . . . . 0.0 112.284 174.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 80.7 p -62.52 -20.26 64.44 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.373 0.669 . . . . 0.0 111.318 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -81.38 2.58 27.83 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.852 1.261 . . . . 0.0 111.882 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.33 19.3 79.64 Favored Glycine 0 C--N 1.353 1.49 0 C-N-CA 122.973 0.32 . . . . 0.0 113.455 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 99' ' ' MET . 73.3 mmtt -106.81 155.79 19.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.581 0.752 . . . . 0.0 110.125 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -104.76 128.85 53.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.878 0.471 . . . . 0.0 109.834 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.556 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 2.0 p90 -148.84 174.34 12.32 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.607 ' HB3' ' HE ' ' A' ' 106' ' ' ARG . 43.8 p90 -130.19 136.12 48.9 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.026 0.53 . . . . 0.0 111.805 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -103.45 115.37 30.41 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 170.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 24.0 tp -80.1 113.62 18.41 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 173.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.437 ' HE2' HG12 ' A' ' 93' ' ' ILE . 35.1 mmtp -97.39 164.11 12.59 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.005 0.922 . . . . 0.0 111.226 -175.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.79 175.27 5.55 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.253 1.021 . . . . 0.0 110.861 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.93 -26.07 65.79 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.131 0.972 . . . . 0.0 111.101 175.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -88.11 12.03 14.67 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.878 0.871 . . . . 0.0 110.946 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 65.2 15.77 10.19 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.821 1.248 . . . . 0.0 112.335 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -82.45 151.14 26.68 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.447 0.699 . . . . 0.0 110.13 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.437 HG12 ' HE2' ' A' ' 87' ' ' LYS . 46.9 mt -87.69 97.57 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.1 pt -85.45 -10.58 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.737 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -165.66 117.12 0.73 Allowed Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.6 p -103.89 113.95 27.85 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 169.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 37.5 t -73.66 166.54 23.09 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.203 0.525 . . . . 0.0 110.926 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -74.35 147.72 41.94 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.318 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.556 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.94 118.19 17.63 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.046 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -95.88 163.5 13.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.773 0.829 . . . . 0.0 110.666 -176.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.2 57.21 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.534 0.734 . . . . 0.0 111.253 -177.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.0 p -128.25 175.87 8.12 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.639 -178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.99 -20.52 61.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.025 0.93 . . . . 0.0 110.917 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -74.93 -42.76 57.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.832 0.853 . . . . 0.0 110.473 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.9 p -69.26 -22.11 63.85 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.822 0.449 . . . . 0.0 111.055 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.607 ' HE ' ' HB3' ' A' ' 84' ' ' PHE . 13.8 ttt180 -62.4 -41.81 98.96 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.626 0.37 . . . . 0.0 110.526 170.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -64.78 -36.1 83.24 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.256 0.622 . . . . 0.0 111.033 -177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.0 m -64.13 -36.85 85.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.881 171.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.88 -31.23 67.3 Favored Glycine 0 C--N 1.353 1.488 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.507 176.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.68 -49.57 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.93 -34.96 77.04 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.429 -1.259 . . . . 0.0 111.379 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t -69.1 -53.12 21.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.202 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.18 -31.56 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.628 0.771 . . . . 0.0 111.229 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -69.92 -50.5 41.5 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.362 0.665 . . . . 0.0 110.972 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.38 -19.25 36.42 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.394 0.678 . . . . 0.0 112.811 -173.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.513 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m120 -100.82 -30.77 11.51 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.647 0.779 . . . . 0.0 110.443 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.88 -17.26 77.53 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 116.089 -0.505 . . . . 0.0 113.62 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -71.18 -14.95 62.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.421 0.689 . . . . 0.0 111.65 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 98.2 p -65.68 -43.27 89.78 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 123.233 0.613 . . . . 0.0 110.223 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 59.25 19.78 7.89 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.705 1.202 . . . . 0.0 111.017 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.1 m -90.17 105.31 17.72 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.208 1.003 . . . . 0.0 109.457 -174.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.99 144.35 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 O-C-N 123.636 0.585 . . . . 0.0 110.895 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.549 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 25.8 mtpp -117.72 100.59 7.7 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 173.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.01 97.78 1.2 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.614 0.721 . . . . 0.0 109.49 -178.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.89 8.39 44.5 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.939 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.403 HG22 ' HG3' ' A' ' 25' ' ' LYS . 49.9 p . . . . . 0 CA--C 1.547 0.837 0 C-N-CA 123.193 0.597 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.312 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 36.1 p90 -154.81 167.14 31.24 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.831 0.852 . . . . 0.0 109.228 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -110.11 133.88 52.75 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.336 0.654 . . . . 0.0 110.035 177.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -98.77 106.13 18.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 165.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.27 128.74 34.96 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -147.02 166.41 26.92 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.823 0.449 . . . . 0.0 109.802 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -109.33 141.33 41.82 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.567 0.747 . . . . 0.0 109.189 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -86.49 -168.58 2.29 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.826 0.851 . . . . 0.0 111.306 -176.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.2 m -60.23 -27.29 67.08 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.614 0.765 . . . . 0.0 112.375 -179.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.449 ' HB3' ' HG2' ' A' ' 30' ' ' GLN . 19.4 t70 -102.23 14.55 31.64 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.844 0.857 . . . . 0.0 110.494 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 62.04 17.84 9.42 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.567 1.147 . . . . 0.0 112.088 -173.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.449 ' HG2' ' HB3' ' A' ' 28' ' ' ASP . 33.5 mm-40 -71.54 141.69 50.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.474 0.71 . . . . 0.0 110.058 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -90.77 115.72 28.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.401 0.681 . . . . 0.0 109.879 -165.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.419 ' HB2' HD23 ' A' ' 48' ' ' LEU . 8.3 tpp180 -140.37 120.46 13.74 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.654 1.182 . . . . 0.0 108.36 -172.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -109.33 138.26 45.96 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.428 0.291 . . . . 0.0 110.345 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.57 132.8 54.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 173.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 13.8 tp -88.39 119.33 28.71 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -105.64 140.15 39.15 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.376 1.071 . . . . 0.0 109.076 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.24 178.5 5.09 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.373 0.669 . . . . 0.0 110.824 173.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -67.51 -17.29 68.55 Favored Glycine 0 C--N 1.35 1.35 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 174.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -66.77 -23.52 66.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.781 0.833 . . . . 0.0 110.946 170.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.35 -7.39 68.92 Favored Glycine 0 C--N 1.349 1.27 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.443 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -90.35 138.75 31.28 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.102 0.961 . . . . 0.0 110.531 -174.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.1 m -69.48 123.93 22.56 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.539 0.736 . . . . 0.0 110.889 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.9 pt -111.86 -19.87 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.578 1.151 . . . . 0.0 111.007 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -156.01 154.91 31.81 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -173.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 96.5 m -155.86 129.19 8.23 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 125.184 1.394 . . . . 0.0 107.793 -176.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 83.2 p -72.75 -170.89 0.76 Allowed 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.677 0.671 . . . . 0.0 111.718 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -91.88 178.51 5.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.734 0.413 . . . . 0.0 110.833 165.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' ' 32' ' ' ARG . 72.8 mt -77.08 113.69 15.07 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.012 174.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -89.72 141.24 28.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.949 170.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 46.3 p -83.2 -11.61 57.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.176 0.59 . . . . 0.0 110.866 176.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.8 m -135.1 135.74 41.43 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.214 1.006 . . . . 0.0 110.285 177.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -28.16 69.61 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.871 0.868 . . . . 0.0 111.401 175.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.6 p -70.2 -31.66 69.22 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.453 0.701 . . . . 0.0 111.092 175.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -70.87 -27.99 64.24 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.611 0.364 . . . . 0.0 110.54 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.15 67.39 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.54 0.736 . . . . 0.0 111.355 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.405 ' HA ' HG22 ' A' ' 59' ' ' ILE . 0.3 OUTLIER -74.23 -29.37 61.68 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 176.666 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.15 -37.27 86.85 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 166.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.41 -48.91 78.74 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.009 0.818 . . . . 0.0 113.438 -178.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 56' ' ' GLU . 10.5 tt -66.68 -33.59 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 120.878 0.371 . . . . 0.0 110.751 177.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.74 81.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.12 0.568 . . . . 0.0 110.703 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.1 m -75.55 -42.04 53.38 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.438 0.695 . . . . 0.0 111.878 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.9 m -66.06 -32.1 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.51 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 51.5 ttp180 -65.43 -47.06 77.51 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.417 1.087 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.3 t -64.1 -26.4 68.53 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.141 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -105.88 10.85 32.35 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.921 0.888 . . . . 0.0 112.511 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.4 m -65.22 -46.87 72.26 Favored Pre-proline 0 CA--C 1.564 1.492 0 CA-C-O 118.525 -0.75 . . . . 0.0 112.054 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.79 -14.13 14.1 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.719 1.613 . . . . 0.0 112.763 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -80.12 94.62 6.02 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.276 0.63 . . . . 0.0 109.454 -177.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.04 -35.6 75.46 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.702 0.801 . . . . 0.0 111.881 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -61.5 -27.34 68.52 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.776 0.83 . . . . 0.0 111.71 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -87.57 -29.76 21.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -171.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.576 ' HB3' ' HG ' ' A' ' 86' ' ' LEU . 14.2 p90 -115.42 125.63 53.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 119.448 1.022 . . . . 0.0 109.161 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -137.91 137.76 38.35 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.515 0.726 . . . . 0.0 110.398 -173.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.455 ' HA ' ' HD1' ' A' ' 84' ' ' PHE . 2.3 ptmm? -76.62 105.12 7.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.251 171.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -91.35 164.68 13.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.707 1.203 . . . . 0.0 110.737 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -127.52 123.76 36.64 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.771 0.828 . . . . 0.0 108.885 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.12 165.54 20.11 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.435 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -60.48 -26.1 66.54 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.98 0.912 . . . . 0.0 111.46 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -84.37 -4.18 58.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.826 0.85 . . . . 0.0 111.636 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.02 62.12 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 122.91 0.291 . . . . 0.0 113.075 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 32.9 mmtp -71.98 129.94 39.76 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.269 0.627 . . . . 0.0 111.446 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -77.49 144.11 37.98 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.366 177.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -151.69 169.24 22.66 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 96' ' ' SER . 20.4 m-85 -105.25 160.13 15.33 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 122.12 -0.363 . . . . 0.0 110.079 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -140.23 103.78 4.67 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 168.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.576 ' HG ' ' HB3' ' A' ' 72' ' ' TYR . 1.4 tt -86.65 109.24 19.05 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -87.68 154.58 20.47 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.404 1.482 . . . . 0.0 110.655 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.46 166.3 10.65 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.55 1.14 . . . . 0.0 110.008 174.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -21.49 66.56 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.524 0.73 . . . . 0.0 111.661 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -86.09 10.69 13.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.123 0.969 . . . . 0.0 111.404 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.0 m80 62.85 25.29 15.01 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 177.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -115.08 156.77 24.58 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.212 1.005 . . . . 0.0 109.631 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.9 mt -87.72 121.28 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 122.818 0.447 . . . . 0.0 110.108 -176.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.6 pt -106.15 -4.95 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.071 0.948 . . . . 0.0 110.51 174.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -154.07 139.34 6.74 Favored Glycine 0 C--N 1.345 1.071 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 84' ' ' PHE . 77.8 p -159.47 169.72 23.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.221 1.408 . . . . 0.0 108.67 -177.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.4 t -132.87 165.39 24.74 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.553 -0.717 . . . . 0.0 110.537 174.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -72.5 -72.97 0.21 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.94 0.896 . . . . 0.0 109.454 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.562 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 22.5 ptp -175.87 139.87 0.41 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.301 1.04 . . . . 0.0 109.993 175.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -104.71 104.16 13.91 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.46 1.104 . . . . 0.0 108.863 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.58 -39.46 84.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.537 0.735 . . . . 0.0 110.893 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.7 p -90.01 133.6 34.72 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.857 173.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.1 -31.76 69.48 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.55 1.14 . . . . 0.0 112.673 -172.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.25 -28.58 68.83 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.458 0.703 . . . . 0.0 111.764 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 41.7 m -64.25 -22.44 66.95 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.882 0.873 . . . . 0.0 112.473 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.422 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.3 ptt180 -69.01 -39.56 79.22 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.37 -50.74 13.43 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.563 0.745 . . . . 0.0 110.103 -176.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.3 m -59.47 -38.35 80.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.994 0.918 . . . . 0.0 110.959 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.82 -35.66 92.18 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.252 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.429 HG23 ' HE2' ' A' ' 72' ' ' TYR . 26.4 mm -58.46 -48.3 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 CA-C-N 117.456 0.628 . . . . 0.0 110.852 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.64 -38.51 90.54 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.135 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -70.84 -42.96 69.47 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.01 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 70.5 t -65.78 -39.01 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.843 0.857 . . . . 0.0 110.391 179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -64.14 -39.46 94.06 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.674 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.23 -36.68 39.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.658 0.783 . . . . 0.0 112.59 -176.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.97 -8.84 17.38 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.074 0.55 . . . . 0.0 111.83 -169.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.04 -34.37 86.57 Favored Glycine 0 C--N 1.346 1.094 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.51 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 15.3 t -75.89 -5.75 47.56 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 124.01 0.924 . . . . 0.0 111.91 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.2 t -65.5 141.66 58.4 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.831 0.453 . . . . 0.0 109.808 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -121.44 8.2 10.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.342 1.057 . . . . 0.0 110.948 -172.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.2 t -97.04 115.84 28.18 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.39 131.33 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.825 0.85 . . . . 0.0 110.199 -178.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -92.32 110.28 21.67 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.631 0.772 . . . . 0.0 109.17 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -83.44 102.86 12.35 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.986 0.898 . . . . 0.0 110.159 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -91.77 -3.38 56.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.512 1.125 . . . . 0.0 110.21 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 27.0 p . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 124.034 0.933 . . . . 0.0 110.882 178.569 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 113.239 0.056 . . . . 0.0 113.239 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -153.05 150.61 29.34 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 123.873 0.869 . . . . 0.0 110.136 -178.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -87.05 143.46 27.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.213 177.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -129.71 111.72 12.93 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.0 tp -79.68 98.37 6.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.2 m -105.92 136.22 45.95 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.241 -170.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HB3' HG22 ' A' ' 126' ' ' THR . 19.4 ptmt -94.75 133.34 38.55 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 170.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 45.9 m -79.29 179.52 7.36 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.648 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.0 t -58.2 -37.98 75.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.046 0.538 . . . . 0.0 111.458 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -92.55 22.52 4.6 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 123.811 0.845 . . . . 0.0 110.77 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 64.31 19.59 11.85 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.513 1.125 . . . . 0.0 112.817 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.401 ' HB2' HD12 ' A' ' 48' ' ' LEU . 88.2 mm-40 -77.59 120.75 22.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.16 0.584 . . . . 0.0 109.692 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 49' ' ' TYR . 50.1 m-85 -89.52 124.2 34.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.645 0.778 . . . . 0.0 109.594 -170.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.605 ' HB2' ' HB2' ' A' ' 46' ' ' SER . 35.9 ptt180 -157.29 158.09 35.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.353 0.661 . . . . 0.0 109.877 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.51 ' HE2' HG23 ' A' ' 122' ' ' VAL . 16.7 m-85 -91.31 141.23 29.0 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.93 0.492 . . . . 0.0 109.805 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.409 HG12 HG23 ' A' ' 45' ' ' THR . 19.8 m -120.67 131.26 73.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 167.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -97.34 111.8 23.89 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -90.41 138.29 31.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.5 176.0 5.07 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.481 0.712 . . . . 0.0 110.135 169.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -60.19 -24.36 60.94 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 114.088 0.395 . . . . 0.0 114.088 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -81.26 0.4 36.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.291 1.037 . . . . 0.0 112.173 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.3 -0.71 89.55 Favored Glycine 0 C--N 1.353 1.512 0 C-N-CA 122.803 0.24 . . . . 0.0 113.599 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -88.21 130.56 35.04 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.455 0.702 . . . . 0.0 110.336 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.8 m -71.95 121.9 19.89 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.294 0.638 . . . . 0.0 110.287 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 pt -102.58 -32.08 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.452 1.101 . . . . 0.0 110.815 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 34.6 tp -132.18 149.45 52.39 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.993 0.917 . . . . 0.0 109.662 -172.438 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.409 HG23 HG12 ' A' ' 34' ' ' VAL . 91.6 m -152.99 125.77 8.35 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.411 1.084 . . . . 0.0 109.462 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.605 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 5.6 m -66.97 170.79 6.2 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.011 0.924 . . . . 0.0 110.583 175.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.1 168.11 20.62 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.7 mm? -71.3 112.48 7.47 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 84.9 m-85 -104.95 137.16 43.14 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 m -73.99 -28.74 61.61 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.161 0.505 . . . . 0.0 110.092 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.497 ' HB3' HG22 ' A' ' 53' ' ' THR . 17.6 m -105.32 132.59 51.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.624 0.77 . . . . 0.0 110.151 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -26.84 62.12 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.231 0.613 . . . . 0.0 111.316 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.497 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -62.09 -36.41 81.62 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.751 0.657 . . . . 0.0 110.89 174.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 m -65.83 -39.06 90.46 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 110.819 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.26 86.39 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.601 0.76 . . . . 0.0 110.455 174.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.64 -34.2 77.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.742 0.817 . . . . 0.0 110.839 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 53' ' ' THR . 64.1 mmtt -76.53 -30.33 57.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.28 -41.61 98.42 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 114.062 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -65.66 -42.32 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 117.112 0.456 . . . . 0.0 111.035 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.11 -36.28 83.79 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.967 0.507 . . . . 0.0 110.74 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.3 m -71.66 -46.03 60.16 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.695 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 33.6 m -67.15 -28.97 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 118.204 0.456 . . . . 0.0 110.8 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -69.21 -38.47 78.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.342 0.657 . . . . 0.0 110.491 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.5 t -76.31 -36.83 58.12 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.855 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -93.0 8.44 39.89 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.18 0.992 . . . . 0.0 111.465 -176.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.493 ' OG ' ' HA ' ' A' ' 114' ' ' LYS . 16.9 t -62.33 -44.94 89.73 Favored Pre-proline 0 CA--C 1.571 1.762 0 C-N-CA 124.709 1.203 . . . . 0.0 112.222 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.81 -6.73 6.62 Favored 'Trans proline' 0 C--N 1.393 2.904 0 C-N-CA 121.845 1.696 . . . . 0.0 113.479 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -83.89 85.75 7.27 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.99 0.516 . . . . 0.0 110.112 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.33 -23.3 67.35 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.864 0.866 . . . . 0.0 112.593 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -66.79 -34.9 78.84 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.649 0.78 . . . . 0.0 111.189 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -76.36 -20.9 56.75 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.11 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -73.21 116.21 13.48 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -96.24 98.38 10.26 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 147.43 38.82 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.946 0.403 . . . . 0.0 110.139 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -144.62 167.96 21.29 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.916 1.287 . . . . 0.0 109.129 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.4 m -126.73 114.73 18.37 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.278 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.11 154.7 5.33 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.855 1.262 . . . . 0.0 111.221 172.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 p -68.92 -12.94 62.11 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.631 0.772 . . . . 0.0 112.266 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -79.74 1.83 25.14 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.55 0.74 . . . . 0.0 111.948 170.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.48 10.59 84.3 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.172 0.295 . . . . 0.0 112.874 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -88.35 141.33 28.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.609 0.764 . . . . 0.0 110.154 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -101.77 128.56 48.05 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.964 0.506 . . . . 0.0 110.119 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.616 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 30.0 p90 -142.75 175.52 9.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -133.96 158.79 42.59 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 122.966 0.506 . . . . 0.0 110.153 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -127.05 100.72 6.24 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.505 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.27 111.54 18.44 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 173.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HE2' HG12 ' A' ' 93' ' ' ILE . 16.2 ptpt -127.93 155.37 44.32 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.558 0.343 . . . . 0.0 110.177 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.47 178.79 6.45 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.464 0.705 . . . . 0.0 110.692 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.28 -10.81 57.33 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.499 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.515 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 2.0 m-20 -80.86 5.4 16.17 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.295 1.038 . . . . 0.0 111.621 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 67.8 11.27 8.29 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.805 1.242 . . . . 0.0 111.976 -178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 4.0 pt20 -106.87 135.11 48.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.781 0.433 . . . . 0.0 110.955 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.422 HG12 ' HE2' ' A' ' 87' ' ' LYS . 55.9 mt -70.85 99.47 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 123.922 0.889 . . . . 0.0 110.131 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.505 HD11 HD22 ' A' ' 86' ' ' LEU . 18.3 pt -79.05 -12.91 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.313 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.44 146.54 9.58 Favored Glycine 0 C--O 1.215 -1.035 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.1 p -166.7 167.16 15.45 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 117.743 0.771 . . . . 0.0 109.772 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.2 t -113.75 165.25 12.74 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -76.78 -54.57 6.45 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.616 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 26.7 ptt? 174.33 131.52 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.75 1.62 . . . . 0.0 108.402 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.549 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 97.3 m-85 -98.28 156.87 16.51 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.072 0.549 . . . . 0.0 109.941 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.65 64.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.822 0.849 . . . . 0.0 111.213 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.5 p -130.39 177.1 7.59 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.54 0.736 . . . . 0.0 110.623 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.37 -28.56 65.21 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.845 172.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -61.82 -40.58 95.79 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.292 0.637 . . . . 0.0 110.572 172.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.549 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 14.6 m -68.55 -35.64 77.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.786 178.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -68.34 -46.14 70.99 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.969 0.508 . . . . 0.0 111.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.09 -28.59 65.53 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.779 0.432 . . . . 0.0 111.357 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 m -64.41 -40.58 96.06 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 168.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.68 99.63 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.785 175.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.9 mm -60.4 -48.88 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.714 0.805 . . . . 0.0 110.258 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.29 83.2 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.298 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.97 -37.55 61.9 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.695 -178.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.57 -30.69 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 123.288 0.635 . . . . 0.0 110.13 176.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HA ' ' OG ' ' A' ' 66' ' ' SER . 37.9 ttpt -70.23 -45.1 67.2 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 120.929 0.395 . . . . 0.0 110.81 172.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.69 -28.74 66.1 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.847 0.859 . . . . 0.0 111.924 -177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.78 -10.23 14.79 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.654 0.781 . . . . 0.0 111.415 -174.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.1 -23.79 75.22 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 112.024 -0.431 . . . . 0.0 112.024 175.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 25.4 p -78.45 -0.52 29.64 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.285 1.034 . . . . 0.0 112.406 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.6 t -70.85 135.69 48.23 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.482 0.713 . . . . 0.0 110.847 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -90.7 -16.48 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 110.335 175.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.5 m -73.98 93.16 2.19 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.752 0.821 . . . . 0.0 110.892 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' VAL . . . . . 0.51 HG23 ' HE2' ' A' ' 33' ' ' PHE . 2.0 p -96.63 132.99 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -126.23 106.6 9.65 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.899 0.88 . . . . 0.0 109.211 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.68 101.85 3.77 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.119 0.568 . . . . 0.0 110.86 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -76.26 -26.25 55.77 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 123.827 0.851 . . . . 0.0 109.977 169.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.52 HG22 ' HB3' ' A' ' 25' ' ' LYS . 31.3 p . . . . . 0 CA--C 1.544 0.729 0 C-N-CA 124.323 1.049 . . . . 0.0 110.95 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.424 0 CA-C-O 120.749 0.083 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 29.5 p90 -141.08 148.75 40.65 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 123.319 0.647 . . . . 0.0 110.368 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.434 ' HB3' ' HD1' ' A' ' 33' ' ' PHE . 85.6 m-85 -98.41 120.29 38.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.943 175.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.443 ' HG2' ' HD3' ' A' ' 123' ' ' LYS . 44.5 mt-10 -92.62 114.09 26.55 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 173.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 31' ' ' PHE . 52.4 tp -80.61 96.63 6.91 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 172.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.7 p -105.04 148.54 26.66 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.134 1.373 . . . . 0.0 109.826 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -102.1 160.25 14.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.51 0.724 . . . . 0.0 111.13 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 96.5 p -89.94 -175.46 4.6 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 166.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.3 p -64.03 -20.21 65.75 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.082 0.553 . . . . 0.0 111.338 172.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -103.01 17.67 23.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.279 1.032 . . . . 0.0 111.339 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 64.74 16.48 10.43 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.841 1.257 . . . . 0.0 112.683 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -72.96 138.51 46.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.074 0.549 . . . . 0.0 110.066 -179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.523 ' HB3' HD11 ' A' ' 23' ' ' LEU . 77.7 m-85 -89.43 133.95 34.31 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.129 0.972 . . . . 0.0 110.159 -166.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB2' HD13 ' A' ' 48' ' ' LEU . 24.4 ttp180 -148.75 120.72 8.21 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -172.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HB3' ' A' ' 21' ' ' PHE . 23.5 m-85 -90.2 124.1 34.57 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.435 HG12 HG23 ' A' ' 45' ' ' THR . 35.4 m -111.18 131.71 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 21.7 tp -100.3 116.43 32.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 95.7 mttt -101.58 128.07 48.0 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 170.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.403 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.14 166.75 7.35 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.948 0.78 . . . . 0.0 111.349 175.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.57 -2.5 35.83 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-N 115.818 -0.628 . . . . 0.0 114.571 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -86.7 -14.0 43.78 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.505 0.722 . . . . 0.0 110.64 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.34 -5.64 41.55 Favored Glycine 0 C--N 1.351 1.405 0 C-N-CA 123.592 0.615 . . . . 0.0 113.758 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -97.46 139.86 32.76 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.295 0.638 . . . . 0.0 110.713 -176.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 20.5 m -67.41 143.81 56.1 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.044 0.938 . . . . 0.0 109.822 174.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.403 HD13 ' HB2' ' A' ' 37' ' ' ALA . 20.8 pt -132.43 -20.5 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.961 0.905 . . . . 0.0 111.362 -176.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -152.5 149.39 28.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.426 0.69 . . . . 0.0 109.498 -170.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.435 HG23 HG12 ' A' ' 34' ' ' VAL . 72.1 m -148.79 117.93 6.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.197 0.999 . . . . 0.0 109.273 177.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.8 t -79.33 172.49 13.72 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.391 0.676 . . . . 0.0 111.062 177.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.42 173.64 9.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.147 0.579 . . . . 0.0 111.649 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.4 mm? -82.83 111.36 18.66 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.482 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.6 m-85 -88.72 131.13 35.16 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.822 1.249 . . . . 0.0 109.164 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -66.49 -30.24 70.53 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.727 0.811 . . . . 0.0 111.414 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.6 m -125.52 143.97 50.76 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.709 0.804 . . . . 0.0 110.446 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.95 68.64 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.818 0.847 . . . . 0.0 111.017 175.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.5 p -62.05 -43.08 99.61 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.38 1.072 . . . . 0.0 110.793 176.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.482 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 8.3 m -65.52 -37.86 87.99 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.153 0.981 . . . . 0.0 110.073 178.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.9 -38.53 88.96 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.943 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.7 -39.66 94.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.08 0.552 . . . . 0.0 110.564 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.93 -37.52 86.26 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.575 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.4 76.36 Favored Glycine 0 C--N 1.35 1.334 0 O-C-N 123.878 0.736 . . . . 0.0 112.868 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.451 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.0 tt -72.04 -31.71 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 122.849 0.459 . . . . 0.0 111.118 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.42 87.24 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.99 0.516 . . . . 0.0 110.356 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.4 m -70.4 -52.14 24.51 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.955 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 59' ' ' ILE . 21.3 m -58.26 -33.05 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 122.585 0.354 . . . . 0.0 111.85 -173.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -66.99 -43.18 83.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.868 0.867 . . . . 0.0 110.799 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.6 t -69.59 -36.06 75.9 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.285 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.432 ' HB3' HD21 ' A' ' 86' ' ' LEU . 13.4 m120 -88.26 -0.42 57.1 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.027 0.931 . . . . 0.0 111.979 -174.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.656 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.5 m -55.03 -52.13 73.7 Favored Pre-proline 0 CA--C 1.565 1.534 0 C-N-CA 123.773 0.829 . . . . 0.0 112.425 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -81.26 -12.53 11.58 Favored 'Trans proline' 0 C--N 1.392 2.818 0 C-N-CA 121.914 1.743 . . . . 0.0 113.034 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -85.62 86.64 7.36 Favored 'General case' 0 C--N 1.351 0.646 0 C-N-CA 123.468 0.707 . . . . 0.0 109.979 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -62.54 -21.77 65.8 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.622 0.769 . . . . 0.0 111.459 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.539 ' HG3' ' HE ' ' A' ' 71' ' ' ARG . 11.7 tp10 -52.8 -36.28 58.11 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.319 1.448 . . . . 0.0 111.634 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HE ' ' HG3' ' A' ' 70' ' ' GLU . 5.1 mmp_? -90.27 0.77 57.07 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.58 0.752 . . . . 0.0 112.884 -174.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -99.48 134.13 42.8 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.911 0.484 . . . . 0.0 110.204 175.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 16.7 mm-40 -100.09 92.93 5.47 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.212 1.005 . . . . 0.0 108.363 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -89.1 101.36 14.02 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.745 0.783 . . . . 0.0 108.961 -176.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -136.16 173.22 11.95 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.698 0.799 . . . . 0.0 110.543 -170.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -120.98 128.01 52.32 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.744 0.817 . . . . 0.0 109.924 -176.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.0 160.43 32.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.726 0.811 . . . . 0.0 109.882 169.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.0 m -65.38 -10.96 37.7 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.196 0.598 . . . . 0.0 112.264 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -76.27 -5.18 45.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.038 0.935 . . . . 0.0 111.385 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.42 9.24 85.16 Favored Glycine 0 C--N 1.351 1.4 0 C-N-CA 123.306 0.479 . . . . 0.0 112.197 -174.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.426 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -97.22 132.81 42.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.242 0.617 . . . . 0.0 111.115 -173.313 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.659 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 62.4 m-85 -94.59 133.89 37.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.322 1.049 . . . . 0.0 110.597 -173.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -145.31 174.8 10.79 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.86 0.864 . . . . 0.0 109.245 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 24.9 p90 -138.69 134.26 33.39 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.277 0.631 . . . . 0.0 110.198 174.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.564 ' HB3' HD12 ' A' ' 93' ' ' ILE . 95.3 m-20 -110.04 120.6 42.96 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.574 0.75 . . . . 0.0 109.402 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.2 129.3 34.8 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.808 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -105.5 137.06 43.95 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.45 1.1 . . . . 0.0 110.448 -168.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.23 169.69 8.3 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.509 0.723 . . . . 0.0 110.082 173.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.59 -21.4 66.33 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.797 0.839 . . . . 0.0 111.904 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.411 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 11.5 m120 -85.79 4.67 35.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.811 0.844 . . . . 0.0 111.784 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.5 m170 70.73 -1.16 2.7 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.276 1.43 . . . . 0.0 112.82 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 30.0 pt20 -75.99 149.33 37.61 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 123.168 0.587 . . . . 0.0 110.467 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 85' ' ' ASN . 41.4 mm -87.37 99.59 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 12.5 pt -79.14 -4.79 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.83 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.16 94.16 0.1 OUTLIER Glycine 0 C--N 1.342 0.871 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.6 p -88.52 125.87 34.98 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.418 ' HB3' ' H ' ' A' ' 84' ' ' PHE . 38.3 t -79.27 169.99 17.29 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 121.675 0.75 . . . . 0.0 110.948 -178.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.41 150.91 39.78 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.119 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 16.5 ptm -76.55 116.5 17.29 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.436 ' HB3' ' OG ' ' A' ' 105' ' ' SER . 62.9 m-85 -102.91 153.16 20.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.856 0.862 . . . . 0.0 111.291 -173.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.85 -52.39 11.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.036 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.2 p -104.18 163.87 12.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.093 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.01 -27.51 61.82 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.05 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.5 -42.13 95.7 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.445 0.698 . . . . 0.0 111.278 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.436 ' OG ' ' HB3' ' A' ' 100' ' ' TYR . 34.5 p -73.29 -30.79 63.64 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.198 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.659 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 27.0 ptt180 -76.87 -36.3 56.86 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.07 0.395 . . . . 0.0 111.446 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.24 -29.87 60.35 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.884 0.373 . . . . 0.0 110.76 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.9 m -69.35 -33.88 73.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.53 167.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.22 -37.38 94.46 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.535 173.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.9 mm -59.82 -48.34 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 174.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.47 -36.23 79.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.361 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -71.25 -52.13 20.68 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.154 0.582 . . . . 0.0 110.831 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.72 -31.05 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.542 0.737 . . . . 0.0 110.928 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.656 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 27.6 ttpp -70.04 -39.47 75.73 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.627 0.771 . . . . 0.0 111.527 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.91 -47.7 43.53 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.495 0.718 . . . . 0.0 111.56 -178.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.06 -20.16 19.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -169.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -69.76 -27.01 73.76 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 123.322 0.389 . . . . 0.0 113.164 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.626 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 72.5 p -67.66 -30.35 69.87 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.646 0.778 . . . . 0.0 111.436 176.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.3 m -83.58 88.05 7.03 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.749 0.82 . . . . 0.0 109.89 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.87 62.53 5.71 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.54 0.686 . . . . 0.0 110.789 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.8 t -101.81 110.72 22.76 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 173.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.9 t -96.42 114.5 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.689 0.796 . . . . 0.0 110.846 -171.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.443 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 84.8 tttt -83.57 115.54 22.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.06 0.944 . . . . 0.0 108.483 166.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -73.86 131.69 41.75 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 0.0 110.287 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -138.91 -8.1 1.39 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.069 0.948 . . . . 0.0 110.395 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.1 p . . . . . 0 CA--C 1.549 0.907 0 CA-C-O 121.084 0.468 . . . . 0.0 110.211 174.794 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.783 0 N-CA-C 113.657 0.223 . . . . 0.0 113.657 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.4 p90 -162.75 165.87 24.98 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.753 0.821 . . . . 0.0 110.683 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 69.1 m-85 -105.44 157.58 17.25 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.534 1.134 . . . . 0.0 108.731 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.494 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 74.8 mt-10 -137.18 110.09 7.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 169.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.7 tp -92.82 106.14 18.15 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 m -129.35 152.0 49.38 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HE3' ' HB ' ' A' ' 126' ' ' THR . 19.1 ptpt -106.51 148.59 28.03 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.038 0.446 . . . . 0.0 110.4 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -72.4 -178.03 2.4 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.345 1.058 . . . . 0.0 111.264 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.0 t -66.74 -29.74 69.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 122.875 0.47 . . . . 0.0 111.247 -178.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -86.52 15.15 5.78 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.026 0.53 . . . . 0.0 111.585 174.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.446 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 17.3 m120 68.68 14.03 8.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.912 1.285 . . . . 0.0 112.748 171.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.48 134.23 35.5 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.605 0.762 . . . . 0.0 109.272 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -86.97 140.52 29.5 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.544 0.738 . . . . 0.0 110.134 -169.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -152.72 115.7 4.6 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -93.35 138.2 31.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.56 HG12 HG23 ' A' ' 45' ' ' THR . 30.4 m -110.8 153.77 12.52 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 172.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 116' ' ' ASN . 0.4 OUTLIER -117.35 123.16 45.81 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.443 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -119.76 146.24 45.83 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 110.359 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -75.4 -178.71 4.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.77 0.828 . . . . 0.0 110.552 172.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -66.14 -17.98 66.47 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.562 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -88.33 -2.37 58.56 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.906 0.882 . . . . 0.0 112.192 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.37 2.82 88.98 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 113.989 0.355 . . . . 0.0 113.989 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -81.68 126.76 32.17 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.029 0.531 . . . . 0.0 110.095 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.1 m -70.09 120.63 16.08 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 pt -100.25 -26.49 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.965 1.306 . . . . 0.0 111.016 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.8 tp -151.54 120.93 6.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.368 0.667 . . . . 0.0 109.395 -174.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.56 HG23 HG12 ' A' ' 34' ' ' VAL . 59.4 m -119.63 122.07 40.71 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.417 0.687 . . . . 0.0 109.543 176.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.506 ' HG ' ' HE2' ' A' ' 49' ' ' TYR . 16.5 t -73.93 -176.28 2.43 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 122.764 0.426 . . . . 0.0 110.569 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -91.94 178.19 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.72 0.408 . . . . 0.0 110.469 172.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.6 mp -84.47 112.42 20.36 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -178.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.506 ' HE2' ' HG ' ' A' ' 46' ' ' SER . 82.1 m-85 -90.33 115.85 27.84 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.145 0.978 . . . . 0.0 108.569 170.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.4 p -69.97 -7.73 43.14 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.01 0.524 . . . . 0.0 111.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.9 m -119.33 135.31 54.78 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.546 1.138 . . . . 0.0 109.738 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -29.36 69.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.929 0.492 . . . . 0.0 110.655 174.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -63.98 -43.78 94.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.125 0.97 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.7 p -74.41 -28.27 61.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.176 0.59 . . . . 0.0 111.362 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.58 -36.01 82.5 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.95 0.5 . . . . 0.0 110.616 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -73.17 -37.19 66.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.578 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -61.07 -39.98 91.94 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.499 172.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.01 85.24 Favored Glycine 0 C--N 1.348 1.244 0 O-C-N 123.867 0.73 . . . . 0.0 113.226 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.2 tt -71.39 -32.0 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 CA-C-O 120.925 0.393 . . . . 0.0 111.0 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 -30.96 70.26 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.799 0.44 . . . . 0.0 110.557 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 m -74.06 -43.32 58.22 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.087 178.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.27 -27.95 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 CA-C-N 118.276 0.489 . . . . 0.0 110.521 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.29 -44.32 79.53 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.648 0.779 . . . . 0.0 109.498 176.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -78.08 -26.64 48.26 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.0 0.52 . . . . 0.0 111.497 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -103.26 13.68 33.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.88 0.872 . . . . 0.0 111.381 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 57.4 p -66.92 -45.89 54.03 Favored Pre-proline 0 CA--C 1.565 1.537 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.828 173.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.29 -7.07 15.97 Favored 'Trans proline' 0 C--N 1.397 3.097 0 CA-C-N 121.873 1.705 . . . . 0.0 112.433 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -83.1 77.16 9.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.537 0.735 . . . . 0.0 110.373 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -60.6 -35.82 77.06 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.703 1.201 . . . . 0.0 112.362 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -74.87 -23.9 58.47 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.272 0.629 . . . . 0.0 110.969 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -77.19 -21.37 54.04 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 123.341 0.657 . . . . 0.0 110.649 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -73.87 104.61 4.81 Favored 'General case' 0 C--N 1.356 0.886 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 167.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -96.86 113.23 24.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.282 0.633 . . . . 0.0 109.292 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 147.05 34.03 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 173.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -147.58 135.59 21.28 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.278 1.031 . . . . 0.0 108.954 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.7 m -98.32 125.19 43.34 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.07 164.85 26.1 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.025 0.93 . . . . 0.0 110.893 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -69.17 -26.37 64.82 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.435 0.694 . . . . 0.0 110.341 178.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -76.35 -4.64 43.33 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.43 1.092 . . . . 0.0 111.244 174.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.44 10.07 74.53 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.868 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -81.44 122.46 27.54 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 122.993 0.517 . . . . 0.0 110.306 -177.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -88.36 126.79 35.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -147.57 175.34 10.93 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -127.0 161.59 28.01 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.381 0.672 . . . . 0.0 110.503 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -140.42 124.19 17.24 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.439 1.096 . . . . 0.0 108.404 176.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.0 tp -84.57 106.59 16.25 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 172.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 91' ' ' HIS . 2.8 tmtm? -86.38 150.13 24.53 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.9 34.38 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.244 0.617 . . . . 0.0 110.365 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.53 -14.48 51.56 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.463 0.705 . . . . 0.0 111.931 177.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -85.94 14.82 5.57 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 0.0 111.475 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.419 ' HA ' ' HE3' ' A' ' 87' ' ' LYS . 71.8 m80 67.07 19.13 10.53 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.905 1.282 . . . . 0.0 112.164 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -109.76 147.45 33.2 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.682 0.793 . . . . 0.0 109.914 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.9 mm -90.12 105.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 170.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.7 pt -87.55 -7.87 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.16 145.71 9.08 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 123.407 0.442 . . . . 0.0 112.605 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -154.45 122.38 5.92 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.205 1.402 . . . . 0.0 108.917 174.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.8 p -67.89 153.74 43.07 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 172.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -60.59 -78.59 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.815 0.697 . . . . 0.0 111.169 -174.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.409 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 24.9 ptt? -173.28 121.97 0.37 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.389 1.076 . . . . 0.0 108.966 176.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -103.27 148.94 25.21 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.71 -37.53 35.47 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.636 174.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.6 p -114.45 147.76 38.81 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.357 0.663 . . . . 0.0 111.76 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.63 -22.45 64.41 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.535 176.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -58.82 -45.11 90.73 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.69 0.796 . . . . 0.0 111.164 173.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m -73.0 -23.99 60.7 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.363 0.665 . . . . 0.0 111.29 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.445 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.9 mtp180 -62.69 -51.11 68.48 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.663 0.385 . . . . 0.0 110.28 168.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -66.54 -34.61 78.29 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.943 0.897 . . . . 0.0 111.061 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.7 m -70.32 -34.68 72.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.929 0.492 . . . . 0.0 109.936 174.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.484 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.14 -50.68 64.59 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.448 173.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 106' ' ' ARG . 40.7 mm -56.4 -45.28 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.244 1.018 . . . . 0.0 110.065 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.84 89.5 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.821 0.848 . . . . 0.0 110.849 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.5 t -73.16 -34.94 66.33 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.763 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 109' ' ' GLY . 75.4 t -69.31 -37.28 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.139 0.576 . . . . 0.0 110.943 -178.175 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 66' ' ' SER . 10.4 mtmp? -69.93 -37.81 76.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.726 0.41 . . . . 0.0 110.616 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.62 76.19 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.71 177.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.446 ' N ' HD21 ' A' ' 116' ' ' ASN . 0.7 OUTLIER -85.25 -11.42 54.88 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.145 0.978 . . . . 0.0 111.588 -176.801 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.07 -36.23 60.67 Favored Glycine 0 C--N 1.344 0.997 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.8 t -82.58 -2.29 53.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.321 0.648 . . . . 0.0 111.308 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.4 t -73.61 160.39 31.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.345 0.658 . . . . 0.0 110.318 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.91 2.8 3.15 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.224 0.61 . . . . 0.0 111.517 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.2 t -79.82 101.25 8.4 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.212 0.605 . . . . 0.0 110.019 178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 m -110.07 141.72 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.03 0.532 . . . . 0.0 109.795 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.494 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 96.6 mttt -106.66 101.48 10.93 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.63 107.07 13.13 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -113.88 15.31 18.6 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.153 0.981 . . . . 0.0 110.922 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.571 ' HB ' ' HE3' ' A' ' 25' ' ' LYS . 46.4 p . . . . . 0 CA--C 1.545 0.786 0 C-N-CA 123.095 0.558 . . . . 0.0 111.56 -176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.453 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.404 ' HA ' HG23 ' A' ' 121' ' ' THR . 43.5 p90 -157.58 155.3 29.93 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.881 0.872 . . . . 0.0 110.051 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.416 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 73.3 m-85 -98.72 140.83 32.34 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.881 0.873 . . . . 0.0 108.772 174.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.423 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 37.3 mt-10 -126.35 111.09 14.1 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 170.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 21.3 tp -92.67 100.22 12.77 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.445 0.698 . . . . 0.0 109.216 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.4 t -116.34 152.61 33.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.87 0.868 . . . . 0.0 109.1 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -95.4 158.09 15.61 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 74.0 p -92.74 173.83 7.57 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.339 0.655 . . . . 0.0 110.381 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 t -69.07 -19.78 64.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.229 0.612 . . . . 0.0 109.87 170.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -87.86 9.31 22.37 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.75 0.82 . . . . 0.0 110.36 172.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 79.77 -22.07 0.3 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 125.254 1.422 . . . . 0.0 113.129 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -68.87 136.06 52.06 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.554 0.741 . . . . 0.0 111.222 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -92.38 131.07 37.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.932 0.893 . . . . 0.0 109.704 -170.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -147.17 121.63 9.7 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.598 0.759 . . . . 0.0 109.549 -173.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -93.07 141.97 27.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 27.6 m -117.45 136.09 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.366 1.066 . . . . 0.0 109.677 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -91.83 115.61 28.2 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.801 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -109.72 123.92 50.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.155 0.982 . . . . 0.0 108.673 174.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.66 170.73 4.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.91 0.484 . . . . 0.0 110.959 172.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.4 -10.13 46.91 Favored Glycine 0 N--CA 1.477 1.415 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.23 -8.34 58.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.614 1.166 . . . . 0.0 110.876 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.06 10.88 84.36 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.883 -176.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -101.85 132.36 47.67 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.13 0.972 . . . . 0.0 109.813 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.0 m -70.17 118.32 12.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 pt -99.78 -16.43 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.167 0.987 . . . . 0.0 110.964 -178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.9 tp -154.65 139.1 16.8 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 40.4 m -135.29 123.44 22.94 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.8 t -79.98 177.68 8.76 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.46 0.704 . . . . 0.0 111.755 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -72.36 166.68 22.04 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.236 0.614 . . . . 0.0 111.812 172.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.01 113.21 18.0 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 171.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.9 m-85 -93.66 138.73 31.58 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.423 0.689 . . . . 0.0 109.947 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t -74.69 -13.78 60.66 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.441 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.8 m -139.31 148.79 43.43 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.832 0.853 . . . . 0.0 110.143 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.8 tmmm? -64.63 -38.72 91.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.285 1.034 . . . . 0.0 108.678 176.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -62.85 -34.46 77.39 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.544 0.738 . . . . 0.0 111.741 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 51.0 m -64.83 -32.76 74.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.22 0.608 . . . . 0.0 111.158 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.12 -29.29 62.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.135 0.574 . . . . 0.0 111.314 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 -37.86 74.94 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.353 0.661 . . . . 0.0 110.077 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 57' ' ' LYS . 8.0 mtpm? -66.39 -35.01 79.24 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.956 171.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.97 91.66 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.586 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.485 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.7 tt -68.16 -36.45 75.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.034 0 CA-C-N 116.952 0.376 . . . . 0.0 110.368 177.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.11 -36.03 72.3 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.012 0.525 . . . . 0.0 110.736 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.0 m -73.64 -47.82 37.13 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.43 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 59' ' ' ILE . 11.1 m -66.42 -28.71 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-N 117.708 0.231 . . . . 0.0 110.854 -178.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.628 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 78.7 ttt-85 -78.22 -39.07 41.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.351 1.06 . . . . 0.0 110.684 -176.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.1 t -70.21 -35.09 73.67 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.3 175.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -97.62 4.59 50.13 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.812 0.845 . . . . 0.0 111.272 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -66.25 -46.52 61.41 Favored Pre-proline 0 CA--C 1.562 1.407 0 C-N-CA 123.904 0.882 . . . . 0.0 111.668 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.63 -18.68 32.73 Favored 'Trans proline' 0 C--N 1.393 2.914 0 C-N-CA 121.761 1.64 . . . . 0.0 112.818 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -95.72 97.23 9.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.957 0.503 . . . . 0.0 110.762 -172.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -21.61 66.71 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.209 0.603 . . . . 0.0 111.721 175.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.38 -33.65 21.35 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.783 1.633 . . . . 0.0 111.775 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -96.03 16.63 17.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.931 0.892 . . . . 0.0 112.069 -172.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -111.01 131.75 54.79 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 6.4 mm-40 -96.21 97.89 9.88 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.979 0.912 . . . . 0.0 109.196 -176.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 105.41 2.75 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.901 0.751 . . . . 0.0 109.915 179.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -136.56 160.99 37.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.498 0.719 . . . . 0.0 110.324 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.0 m -127.57 116.48 20.41 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.725 176.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.52 153.23 13.28 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 110.858 170.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -61.65 -15.26 38.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.839 0.856 . . . . 0.0 112.452 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -86.61 11.72 12.19 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.879 0.871 . . . . 0.0 111.618 178.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.28 24.84 74.54 Favored Glycine 0 C--N 1.352 1.437 0 O-C-N 123.105 0.253 . . . . 0.0 112.738 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.1 mmtp -109.4 123.12 48.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.351 0.66 . . . . 0.0 110.219 -175.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -79.68 135.38 36.53 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.495 0.718 . . . . 0.0 109.905 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -151.47 140.07 20.67 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 4.0 m-85 -109.52 133.22 53.35 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.451 HD22 HD13 ' A' ' 93' ' ' ILE . 9.6 m-20 -105.63 125.38 50.91 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.456 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.86 122.36 28.13 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -86.24 138.23 32.02 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.438 1.095 . . . . 0.0 109.644 -175.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.544 ' HB2' HG23 ' A' ' 94' ' ' ILE . . . -95.15 168.25 10.87 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.904 0.882 . . . . 0.0 110.37 175.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.15 -19.48 62.42 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.233 0.613 . . . . 0.0 111.051 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.454 ' HB3' ' HG2' ' A' ' 92' ' ' GLN . 62.1 t30 -82.72 0.85 41.56 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.891 0.877 . . . . 0.0 111.543 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 69.43 18.08 7.95 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.688 1.195 . . . . 0.0 111.62 -176.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.454 ' HG2' ' HB3' ' A' ' 90' ' ' ASN . 4.2 pt20 -100.87 -170.49 1.85 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.634 0.774 . . . . 0.0 109.236 173.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.451 HD13 HD22 ' A' ' 85' ' ' ASN . 59.3 mt -106.63 148.01 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 175.359 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.544 HG23 ' HB2' ' A' ' 88' ' ' ALA . 5.6 pt -126.83 -1.15 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.25 1.02 . . . . 0.0 111.058 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 176.78 104.2 0.18 Allowed Glycine 0 C--N 1.35 1.361 0 N-CA-C 114.118 0.407 . . . . 0.0 114.118 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 m -88.83 125.87 35.1 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 98.6 p -75.81 167.37 22.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 120.76 0.314 . . . . 0.0 111.088 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -60.94 157.31 15.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.699 0.8 . . . . 0.0 110.613 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.408 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 25.3 ptt? -78.7 119.43 21.92 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 121.17 0.509 . . . . 0.0 109.892 178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -98.47 120.11 38.32 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.97 0.908 . . . . 0.0 109.543 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.09 -35.29 71.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.992 0.517 . . . . 0.0 110.774 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 m -100.25 154.47 18.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.286 0.634 . . . . 0.0 110.413 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -84.44 -24.75 29.4 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.768 0.827 . . . . 0.0 111.851 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -79.8 -32.15 40.76 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 173.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -29.77 69.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.961 0.505 . . . . 0.0 111.698 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.8 ptt180 -65.98 -33.54 76.05 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.502 177.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -69.04 -42.44 76.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.202 0.601 . . . . 0.0 110.095 -179.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.4 m -69.64 -41.96 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.519 0.728 . . . . 0.0 111.062 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -68.71 -38.1 85.32 Favored Glycine 0 C--N 1.342 0.901 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.933 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.464 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 35.5 mm -76.77 -38.82 30.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.711 0.405 . . . . 0.0 110.206 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.44 -26.83 68.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.619 0.368 . . . . 0.0 110.757 173.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.5 t -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 92.6 t -59.28 -37.21 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.564 0.746 . . . . 0.0 110.796 175.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 110' ' ' ILE . 7.5 mtpm? -71.27 -33.1 69.47 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.545 0.738 . . . . 0.0 111.026 177.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.42 -51.71 14.17 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.626 0.771 . . . . 0.0 112.558 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -103.77 -4.15 24.02 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.819 0.847 . . . . 0.0 112.267 -173.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.74 -20.52 78.69 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.723 -0.217 . . . . 0.0 113.056 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.628 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 13.8 t -81.24 3.58 23.36 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.599 0.759 . . . . 0.0 111.596 176.507 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.0 t -89.93 169.3 11.34 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.766 0.426 . . . . 0.0 110.696 178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -123.35 11.09 9.3 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.797 0.839 . . . . 0.0 111.3 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 20' ' ' TRP . 6.2 t -74.46 80.94 1.93 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-O 121.739 0.781 . . . . 0.0 111.53 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 27.7 m -97.49 124.69 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.357 0.663 . . . . 0.0 110.499 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 3.7 mptp? -96.29 82.12 3.39 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 171.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 7.1 p-10 -72.56 96.77 2.01 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.021 0.915 . . . . 0.0 109.025 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -93.42 8.8 39.12 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.783 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 42.6 p . . . . . 0 CA--C 1.547 0.853 0 C-N-CA 124.411 1.084 . . . . 0.0 110.095 174.386 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 36' ' ' LYS . . . . . . . . 0 CA--C 1.524 0.607 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.435 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.5 p90 -161.35 153.16 19.38 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.608 0.763 . . . . 0.0 110.786 -173.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.487 ' HB2' HG22 ' A' ' 122' ' ' VAL . 97.5 m-85 -88.51 156.74 18.92 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.463 0.705 . . . . 0.0 109.391 169.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -138.58 107.67 6.04 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 33' ' ' PHE . 37.7 tp -95.46 101.12 12.81 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.344 0.658 . . . . 0.0 109.571 -177.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.3 t -116.84 -177.74 3.27 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 123.629 0.771 . . . . 0.0 109.022 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -141.39 161.27 38.31 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -82.95 177.36 8.66 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.18 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.8 m -70.64 -22.36 62.52 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.132 0.573 . . . . 0.0 110.184 172.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.28 -5.22 48.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.841 0.856 . . . . 0.0 111.851 171.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 69.78 27.15 4.67 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.984 1.314 . . . . 0.0 111.698 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -87.15 119.66 27.61 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -88.61 142.26 27.84 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.74 0.816 . . . . 0.0 109.314 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.428 ' HD2' HD23 ' A' ' 48' ' ' LEU . 58.8 ttt180 -157.43 117.37 3.41 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 -171.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.431 ' HB3' HD13 ' A' ' 23' ' ' LEU . 46.9 p90 -98.82 133.06 43.67 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 HG23 ' A' ' 45' ' ' THR . 17.7 m -107.78 130.76 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.687 0.795 . . . . 0.0 109.05 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.4 tp -100.67 117.57 35.06 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 97.6 mttt -120.37 142.01 49.56 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.591 1.157 . . . . 0.0 109.516 -176.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.34 -175.92 0.87 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.067 0.947 . . . . 0.0 111.677 173.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.98 -21.76 63.94 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 -176.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -84.34 -4.3 58.79 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.644 0.777 . . . . 0.0 112.533 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.84 8.4 87.71 Favored Glycine 0 C--N 1.343 0.943 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -82.42 132.15 35.21 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.729 0.812 . . . . 0.0 109.423 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.3 m -64.97 123.76 20.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.358 0.663 . . . . 0.0 112.007 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.484 HD11 ' HG ' ' A' ' 35' ' ' LEU . 29.9 pt -105.85 -14.45 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.141 0.976 . . . . 0.0 110.401 172.09 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 11.6 tp -165.59 144.49 6.26 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.795 0.838 . . . . 0.0 109.002 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.465 HG23 HG12 ' A' ' 34' ' ' VAL . 26.9 m -152.19 114.01 4.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.956 0.903 . . . . 0.0 109.221 176.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.3 m -64.26 170.17 3.99 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.212 1.005 . . . . 0.0 112.014 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.65 174.63 11.39 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.888 0.375 . . . . 0.0 110.21 175.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.428 HD23 ' HD2' ' A' ' 32' ' ' ARG . 66.6 mt -71.71 113.66 8.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.183 0.593 . . . . 0.0 109.748 177.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -90.02 137.4 32.37 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.393 0.677 . . . . 0.0 109.998 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.9 t -69.16 -21.49 63.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.225 0.61 . . . . 0.0 111.624 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p -149.68 156.7 42.32 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.777 0.831 . . . . 0.0 110.371 -174.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -66.94 -28.82 68.6 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 177.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.9 p -59.0 -39.86 83.1 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 123.982 0.801 . . . . 0.0 110.79 176.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.9 m -71.85 -30.05 65.04 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.715 0.806 . . . . 0.0 111.383 177.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.67 -39.06 64.7 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.216 0.606 . . . . 0.0 110.986 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.73 -34.96 72.43 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.881 0.872 . . . . 0.0 110.058 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -62.07 -44.0 97.62 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.367 1.067 . . . . 0.0 109.74 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.84 -49.37 78.67 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.227 0.955 . . . . 0.0 113.042 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.568 ' HA ' HG22 ' A' ' 62' ' ' VAL . 14.9 tt -72.78 -33.83 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 122.297 0.239 . . . . 0.0 111.364 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.8 -32.07 73.39 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.901 0.48 . . . . 0.0 110.934 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.5 m -75.92 -45.45 35.1 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.509 176.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' A' ' 59' ' ' ILE . 24.1 m -66.66 -36.62 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 118.005 0.366 . . . . 0.0 111.185 -175.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.09 73.53 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.337 0.589 . . . . 0.0 110.142 -177.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.6 t -77.33 -32.7 55.39 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.973 0.909 . . . . 0.0 110.372 177.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -99.57 10.7 40.88 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.698 0.799 . . . . 0.0 111.385 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.566 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.6 m -58.76 -46.82 99.54 Favored Pre-proline 0 N--CA 1.484 1.251 0 C-N-CA 123.391 0.676 . . . . 0.0 112.618 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.18 -13.07 15.63 Favored 'Trans proline' 0 C--N 1.391 2.782 0 C-N-CA 121.559 1.506 . . . . 0.0 113.124 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -82.71 77.64 9.43 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -178.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 0.4 OUTLIER -64.45 -20.66 66.31 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.979 -177.861 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -67.05 -37.89 84.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.767 0.827 . . . . 0.0 110.923 174.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -71.01 -23.61 62.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.273 0.629 . . . . 0.0 111.679 178.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.413 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 67.8 m-85 -71.63 115.33 10.69 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 164.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.23 117.76 32.16 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.097 0.959 . . . . 0.0 108.865 -173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HD2' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.72 105.36 4.99 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 110.633 -174.283 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -100.18 115.32 29.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.325 1.05 . . . . 0.0 109.52 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.0 m -112.75 111.44 22.23 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB3' ' HB2' ' A' ' 81' ' ' LYS . . . -69.37 153.04 44.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.393 173.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 p -61.82 -21.29 64.5 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.826 0.85 . . . . 0.0 111.573 175.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -84.03 11.51 7.8 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.821 0.848 . . . . 0.0 111.493 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.48 17.25 77.71 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 113.236 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 75.5 mmtt -84.25 123.12 29.8 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -102.8 124.14 47.77 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.464 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 8.1 p90 -152.81 177.94 10.18 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.955 1.302 . . . . 0.0 108.467 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.56 157.41 44.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.507 0.323 . . . . 0.0 111.329 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -135.61 129.97 33.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.112 0.565 . . . . 0.0 110.183 168.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.777 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -81.07 115.23 20.41 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -94.11 137.59 33.13 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.805 0.842 . . . . 0.0 109.794 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -93.95 175.85 6.56 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.004 0.922 . . . . 0.0 110.74 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.73 -23.41 66.74 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.77 0.828 . . . . 0.0 111.474 175.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -84.57 5.24 28.53 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.216 1.007 . . . . 0.0 111.566 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 66.95 10.46 7.67 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.087 1.355 . . . . 0.0 112.238 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.17 148.64 23.54 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.094 0.557 . . . . 0.0 110.558 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.528 HG21 ' HB2' ' A' ' 96' ' ' SER . 54.9 mt -78.22 99.99 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 170.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.777 HD11 HD22 ' A' ' 86' ' ' LEU . 14.3 pt -81.26 -6.75 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.222 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -179.58 121.31 0.73 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-O 119.345 -0.697 . . . . 0.0 111.812 173.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.528 ' HB2' HG21 ' A' ' 93' ' ' ILE . 23.1 t -119.31 113.71 21.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.858 0.863 . . . . 0.0 110.468 177.228 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.5 t -65.29 161.14 20.11 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.762 0.825 . . . . 0.0 111.372 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -88.95 163.46 15.56 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.296 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.554 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 17.6 ptt? -73.14 120.68 19.09 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.388 0.675 . . . . 0.0 111.668 -173.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -101.11 157.12 17.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.208 173.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.46 -46.0 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.837 0.455 . . . . 0.0 111.277 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.5 p -101.45 153.74 19.43 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 123.27 0.628 . . . . 0.0 110.88 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.41 82.44 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.888 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -59.56 -29.94 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.417 0.687 . . . . 0.0 112.763 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.2 m -71.56 -40.48 69.95 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 112.073 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.447 ' O ' HG12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -76.21 -26.83 56.51 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.395 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -65.89 -43.13 89.14 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 122.983 0.513 . . . . 0.0 110.138 172.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.7 m -63.6 -33.9 76.63 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.897 171.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.34 -40.0 98.44 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.944 0.777 . . . . 0.0 113.247 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 106' ' ' ARG . 44.5 mm -60.04 -46.22 94.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-O 121.213 0.53 . . . . 0.0 109.741 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.92 78.9 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.52 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.4 t -71.8 -43.27 65.95 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.147 0.579 . . . . 0.0 110.455 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.3 t -73.56 -24.72 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.43 0.692 . . . . 0.0 110.56 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.566 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.7 OUTLIER -62.47 -45.88 91.04 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 172.682 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.41 -50.15 16.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.998 -175.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -84.17 -26.9 28.45 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.154 0.982 . . . . 0.0 111.178 -172.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLY . . . . . 0.446 ' HA2' ' HZ ' ' A' ' 21' ' ' PHE . . . -65.41 -43.2 95.31 Favored Glycine 0 C--N 1.346 1.114 0 O-C-N 123.613 0.571 . . . . 0.0 112.797 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 46.6 p -68.56 -27.7 66.31 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.586 0.754 . . . . 0.0 111.76 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -75.28 121.81 22.75 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.425 0.69 . . . . 0.0 110.15 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.04 43.34 1.14 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.368 1.067 . . . . 0.0 111.159 -174.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.435 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.6 t -95.36 111.93 23.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.108 0.963 . . . . 0.0 108.847 176.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 21' ' ' PHE . 27.0 t -134.73 135.33 53.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.245 0.618 . . . . 0.0 110.044 -174.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -91.38 95.31 9.92 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 166.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -75.12 95.03 3.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.689 0.757 . . . . 0.0 109.292 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -107.31 27.35 9.17 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.581 -1.191 . . . . 0.0 110.393 -178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 45.3 p . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 123.669 0.788 . . . . 0.0 110.814 -177.617 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.652 0 N-CA-C 112.033 -0.427 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -146.1 157.38 43.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.167 0.987 . . . . 0.0 109.581 -177.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -99.5 151.31 21.28 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.468 0.707 . . . . 0.0 110.015 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 48.3 mt-10 -137.29 115.05 11.33 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.431 1.092 . . . . 0.0 108.5 171.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.6 tp -80.45 98.41 7.52 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.3 p -94.09 155.06 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.343 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 29' ' ' ASN . 12.5 ptmm? -113.65 165.81 12.16 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.495 0.718 . . . . 0.0 109.285 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -102.27 -178.94 3.84 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.055 0.542 . . . . 0.0 109.955 174.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.4 t -65.9 -27.21 68.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.032 0.533 . . . . 0.0 110.351 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.24 2.87 22.75 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.78 0.832 . . . . 0.0 111.728 174.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.432 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 12.3 t30 70.35 9.64 7.03 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.876 1.27 . . . . 0.0 111.477 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -74.63 131.48 40.95 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.153 0.581 . . . . 0.0 109.997 -177.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -92.58 137.63 32.2 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.03 0.932 . . . . 0.0 110.384 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -155.65 141.6 18.18 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -103.24 136.82 42.3 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 HG23 ' A' ' 45' ' ' THR . 27.7 m -107.36 132.82 53.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 175.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.7 tp -100.22 114.98 28.82 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 171.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.54 141.61 35.71 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.395 1.078 . . . . 0.0 108.897 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.27 175.46 10.63 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.038 0.535 . . . . 0.0 110.201 171.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.94 -7.45 56.09 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 113.914 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -73.17 -18.37 61.28 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.001 0.92 . . . . 0.0 111.053 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.61 -7.51 74.47 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.413 -173.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -88.48 136.91 32.76 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.095 0.958 . . . . 0.0 110.176 -177.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.7 m -75.78 121.41 22.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.014 0.526 . . . . 0.0 109.786 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.39 -25.14 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.898 0.879 . . . . 0.0 110.839 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.0 tp -148.01 143.6 27.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.218 0.607 . . . . 0.0 109.963 -171.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.405 HG23 HG12 ' A' ' 34' ' ' VAL . 87.8 m -149.81 129.93 13.58 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.197 0.999 . . . . 0.0 108.806 175.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.4 p -78.6 170.85 16.0 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.134 0.573 . . . . 0.0 111.024 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 93' ' ' ILE . 7.9 pt-20 -70.17 170.15 12.17 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.078 0.551 . . . . 0.0 111.049 175.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.25 112.12 13.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -92.79 142.06 27.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.061 0.945 . . . . 0.0 109.761 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.7 p -72.51 -25.93 61.58 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.295 0.638 . . . . 0.0 111.022 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.5 m -124.42 138.43 54.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.926 0.89 . . . . 0.0 110.153 -175.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -67.47 -28.12 67.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.858 0.463 . . . . 0.0 110.475 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.5 p -57.67 -40.77 80.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.161 0.984 . . . . 0.0 110.985 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -65.93 -35.14 79.78 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.917 0.887 . . . . 0.0 111.127 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.3 -33.15 61.17 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.44 0.696 . . . . 0.0 111.411 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -69.86 -43.54 71.66 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.631 0.773 . . . . 0.0 110.195 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.13 -22.45 52.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.58 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.18 75.69 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.708 0.63 . . . . 0.0 112.622 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' HG22 ' A' ' 62' ' ' VAL . 6.1 tt -67.48 -33.07 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 122.699 0.4 . . . . 0.0 110.795 176.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.81 82.32 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.107 0.479 . . . . 0.0 110.346 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -76.09 -39.64 54.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.355 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 59' ' ' ILE . 19.9 m -64.59 -33.11 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 CA-C-N 119.204 0.911 . . . . 0.0 110.495 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -70.6 -39.4 73.81 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 124.265 0.978 . . . . 0.0 110.624 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.8 t -74.14 -30.72 62.43 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.539 0.736 . . . . 0.0 110.841 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -107.55 18.35 21.59 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.786 0.835 . . . . 0.0 111.256 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.63 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 55.5 m -59.81 -49.63 90.66 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 123.398 0.679 . . . . 0.0 111.762 168.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.66 -4.65 12.97 Favored 'Trans proline' 0 C--N 1.398 3.165 0 C-N-CA 121.968 1.779 . . . . 0.0 113.098 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -92.67 81.7 4.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.965 0.506 . . . . 0.0 110.126 -173.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.55 -29.99 59.97 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 124.52 1.128 . . . . 0.0 112.265 176.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -63.26 -35.39 80.2 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.164 1.386 . . . . 0.0 110.514 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -76.14 -23.11 54.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.609 0.764 . . . . 0.0 112.117 -176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -73.91 138.63 44.4 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 73.3 mm-40 -98.97 95.34 7.08 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.7 103.68 15.38 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 56.7 mttm -124.5 157.3 35.62 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 109.348 -175.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.5 m -127.23 115.54 19.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.644 0.778 . . . . 0.0 109.563 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.23 159.7 5.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.162 0.985 . . . . 0.0 111.83 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.6 p -57.69 -27.0 62.51 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.328 1.051 . . . . 0.0 112.806 -174.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -88.83 16.53 6.71 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 112.109 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.77 31.83 62.03 Favored Glycine 0 C--N 1.35 1.339 0 CA-C-N 116.372 -0.376 . . . . 0.0 113.335 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.7 mmtt -101.41 122.1 43.14 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.082 0.553 . . . . 0.0 109.848 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -95.2 130.86 41.76 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.484 0.714 . . . . 0.0 109.491 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.448 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 45.6 p90 -149.37 161.44 42.06 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.302 0.641 . . . . 0.0 109.616 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 42.2 p90 -130.91 135.9 48.1 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.206 0.602 . . . . 0.0 109.865 176.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -112.64 117.21 31.65 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 172.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 94' ' ' ILE . 0.8 OUTLIER -76.68 109.38 10.4 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.337 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -90.22 137.67 32.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.857 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -100.01 154.69 18.19 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.522 0.729 . . . . 0.0 109.19 169.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.03 -16.44 61.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -74.8 1.85 11.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.474 1.11 . . . . 0.0 111.993 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.0 m170 68.6 14.71 9.08 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.238 1.415 . . . . 0.0 111.428 -177.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -103.86 140.86 37.09 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.308 0.643 . . . . 0.0 109.632 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 47' ' ' GLU . 51.2 mm -80.13 98.39 3.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.996 0.919 . . . . 0.0 108.877 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 86' ' ' LEU . 24.7 pt -81.99 -12.9 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.511 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.69 142.17 8.51 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 t -153.55 165.29 36.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.645 0.778 . . . . 0.0 109.63 175.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 t -143.7 148.76 36.2 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.398 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.2 pp0? -68.93 -42.61 76.54 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.715 0.635 . . . . 0.0 110.483 -175.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.469 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 27.7 ptt? 176.24 155.08 0.21 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.425 1.49 . . . . 0.0 108.632 171.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -103.59 128.68 50.82 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 165.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.58 98.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.914 0.886 . . . . 0.0 111.587 -173.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 p -111.81 146.59 37.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.097 0.959 . . . . 0.0 110.425 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -75.33 -16.66 60.39 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.637 0.775 . . . . 0.0 111.797 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.66 -33.37 62.49 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.399 0.68 . . . . 0.0 110.384 173.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.1 t -67.88 -20.08 65.09 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 17.2 ptt180 -55.99 -37.85 69.67 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 122.915 0.486 . . . . 0.0 110.97 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.18 -39.31 71.93 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.339 1.056 . . . . 0.0 110.127 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.82 -40.12 96.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.142 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.73 -47.04 70.05 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.888 -178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 43.1 mm -59.38 -45.16 93.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 122.785 0.434 . . . . 0.0 109.963 176.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.35 86.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.579 0.751 . . . . 0.0 111.423 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.2 t -76.05 -38.27 57.33 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.163 0.585 . . . . 0.0 111.058 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.32 -34.58 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.384 0.673 . . . . 0.0 110.538 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.9 OUTLIER -69.17 -48.66 61.62 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.48 0.712 . . . . 0.0 109.963 178.551 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 118' ' ' THR . . . -70.26 -51.28 31.81 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.142 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -83.53 0.21 47.51 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.453 0.701 . . . . 0.0 111.96 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.94 -30.97 72.23 Favored Glycine 0 C--N 1.347 1.147 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 115' ' ' ALA . 11.5 t -85.23 0.78 50.78 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.786 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.1 m -67.15 108.87 2.83 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 122.905 0.482 . . . . 0.0 110.214 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -73.33 -14.61 61.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.746 0.418 . . . . 0.0 111.462 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.4 t -66.04 103.55 0.97 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.571 0.748 . . . . 0.0 110.282 176.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.51 122.37 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 123.867 0.867 . . . . 0.0 110.064 177.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.45 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 22.1 mtpp -83.05 148.36 27.59 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.078 173.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -106.24 94.83 5.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -81.89 -10.98 59.13 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.841 0.856 . . . . 0.0 111.152 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.412 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 37.8 p . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 124.363 1.065 . . . . 0.0 112.261 -174.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.364 -0.294 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.9 m -95.27 157.35 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.837 0.855 . . . . 0.0 110.917 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.2 pt -69.87 123.85 24.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 123.118 0.567 . . . . 0.0 110.536 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -86.47 146.05 26.57 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.57 90.26 2.82 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.27 -169.65 22.89 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.265 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.1 p90 -160.03 150.13 18.39 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.195 0.522 . . . . 0.0 111.027 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -94.32 149.35 21.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.178 0.991 . . . . 0.0 108.598 170.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.6 mt-10 -131.37 109.5 10.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 171.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.5 tp -87.16 107.98 18.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.5 t -122.62 142.96 50.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.935 0.894 . . . . 0.0 109.045 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -94.7 139.65 30.95 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 171.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.0 m -76.38 -175.54 3.29 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 0.0 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.6 t -61.16 -25.78 67.25 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.062 0.545 . . . . 0.0 111.181 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -95.63 16.16 18.01 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.053 0.941 . . . . 0.0 110.787 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 64.06 17.62 10.73 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.261 1.424 . . . . 0.0 112.992 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 86.5 mm-40 -82.5 127.49 33.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.529 0.731 . . . . 0.0 110.724 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -85.89 122.11 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.836 0.854 . . . . 0.0 109.076 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -147.39 120.39 8.79 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 124.171 0.989 . . . . 0.0 108.556 -172.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -99.18 137.9 37.04 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.3 m -107.53 131.72 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.6 tp -91.36 123.49 34.82 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -115.7 149.76 37.89 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 109.172 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.54 -173.75 4.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.313 1.045 . . . . 0.0 110.275 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -57.34 -34.6 68.38 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 114.509 0.564 . . . . 0.0 114.509 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -88.66 8.1 30.26 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.623 0.769 . . . . 0.0 112.005 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 6.43 89.3 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.797 -0.183 . . . . 0.0 113.302 -176.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.85 110.06 4.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 110.424 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -65.08 121.37 14.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 pt -114.38 -20.78 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.61 1.164 . . . . 0.0 110.897 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -147.81 146.52 29.17 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.9 m -145.78 118.12 8.44 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.745 0.818 . . . . 0.0 108.936 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 98.1 p -69.21 170.19 10.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.748 0.419 . . . . 0.0 110.871 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.84 175.15 10.32 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 121.358 0.599 . . . . 0.0 110.895 174.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 89.0 mt -75.67 113.03 12.65 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.86 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.533 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 66.6 m-85 -100.97 133.61 45.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.685 0.794 . . . . 0.0 109.319 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.3 m -68.34 -25.56 65.16 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.155 0.582 . . . . 0.0 111.059 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -130.05 147.09 51.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.474 0.71 . . . . 0.0 110.981 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -27.8 68.77 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.781 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.8 p -57.63 -36.69 72.15 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.815 0.846 . . . . 0.0 111.782 175.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.533 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 13.2 m -69.8 -33.03 71.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.605 0.762 . . . . 0.0 110.752 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.67 59.89 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.531 0.732 . . . . 0.0 111.503 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -69.39 -45.26 69.72 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.288 0.635 . . . . 0.0 109.759 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -71.29 -24.72 62.2 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.81 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -64.14 -51.13 55.64 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.543 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.8 tt -71.39 -34.29 53.06 Favored 'Isoleucine or valine' 0 C--N 1.357 0.911 0 CA-C-N 116.641 0.221 . . . . 0.0 111.02 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.72 86.25 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.245 0.545 . . . . 0.0 110.275 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.6 m -74.17 -43.67 56.41 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.365 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 59' ' ' ILE . 13.2 m -65.05 -29.23 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-N 119.046 0.839 . . . . 0.0 111.036 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -76.02 -35.44 59.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.041 0.536 . . . . 0.0 110.277 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -77.83 -31.77 51.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.462 0.705 . . . . 0.0 110.844 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -101.92 12.13 37.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.752 0.821 . . . . 0.0 110.9 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.9 t -64.35 -48.93 74.68 Favored Pre-proline 0 CA--C 1.559 1.325 0 C-N-CA 123.919 0.888 . . . . 0.0 111.285 174.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -78.99 -9.52 15.47 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 121.744 1.629 . . . . 0.0 112.733 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -84.92 81.22 8.99 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -59.68 -28.09 66.98 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.377 1.071 . . . . 0.0 112.256 -177.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -78.54 -23.88 45.97 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NE ' ' HB2' ' A' ' 87' ' ' LYS . 6.5 tpm_? -75.5 -21.9 57.62 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 111.435 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -70.48 133.51 46.88 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 169.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 43.5 mm-40 -96.18 97.11 9.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -78.31 103.63 8.38 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.854 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -122.4 159.49 27.44 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.872 1.269 . . . . 0.0 110.056 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.5 m -128.26 115.94 19.09 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.443 0.697 . . . . 0.0 109.732 174.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.18 156.47 31.66 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.802 0.841 . . . . 0.0 111.342 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.4 m -67.08 -10.8 53.82 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 124.028 0.931 . . . . 0.0 111.811 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.86 4.9 17.66 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 123.902 0.881 . . . . 0.0 110.083 172.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 34.13 67.87 Favored Glycine 0 C--N 1.352 1.434 0 C-N-CA 123.206 0.432 . . . . 0.0 112.731 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.6 mmtt -114.32 124.52 52.2 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.188 0.595 . . . . 0.0 110.211 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.49 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 77.4 m-85 -91.78 125.79 36.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.308 0.643 . . . . 0.0 109.876 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.635 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 25.3 p90 -146.66 174.75 11.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.244 1.018 . . . . 0.0 108.921 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.498 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 44.9 p90 -145.0 135.49 24.29 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.786 0.326 . . . . 0.0 111.345 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.54 ' HB3' HD12 ' A' ' 93' ' ' ILE . 6.1 m-20 -112.48 114.88 27.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.589 0.756 . . . . 0.0 109.328 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 41.5 tp -80.23 119.06 22.48 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.442 ' HB2' ' NE ' ' A' ' 71' ' ' ARG . 34.0 mmtp -87.11 156.85 19.55 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.009 0.924 . . . . 0.0 111.27 -177.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.6 175.14 5.6 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.227 167.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.39 -28.25 69.86 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.525 0.678 . . . . 0.0 110.63 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -81.91 10.81 5.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.456 1.103 . . . . 0.0 112.153 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 66.59 4.89 3.54 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.78 1.232 . . . . 0.0 111.983 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -85.38 140.83 30.45 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.771 0.828 . . . . 0.0 110.427 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.54 HD12 ' HB3' ' A' ' 85' ' ' ASN . 20.5 mm -76.14 99.67 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 14.2 pt -79.44 -11.37 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.019 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.38 108.2 0.26 Allowed Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.3 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.423 ' HB3' HG21 ' A' ' 93' ' ' ILE . 77.8 p -92.01 134.54 34.72 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -88.39 160.32 17.63 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.169 0.509 . . . . 0.0 109.855 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.82 141.42 48.01 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.865 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.635 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.1 ptt? -73.47 116.51 14.13 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.413 0.625 . . . . 0.0 109.645 -176.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -93.35 158.32 15.8 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.252 -176.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 -54.68 7.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 122.567 0.347 . . . . 0.0 110.453 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 p -97.36 155.85 16.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.371 0.668 . . . . 0.0 111.782 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -70.49 -33.54 71.34 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.641 0.777 . . . . 0.0 110.895 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -63.08 -32.19 73.51 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.004 0.522 . . . . 0.0 111.292 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -71.48 -30.1 65.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.432 0.693 . . . . 0.0 110.662 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.49 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 57.5 ttp180 -69.77 -38.73 76.85 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.319 0.648 . . . . 0.0 109.949 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 22.3 mm-40 -71.14 -40.08 71.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.244 0.618 . . . . 0.0 110.986 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.4 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.466 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.94 -44.63 97.56 Favored Glycine 0 C--N 1.347 1.18 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.471 174.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.93 -46.44 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.435 0.694 . . . . 0.0 109.961 176.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.48 80.23 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.923 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.5 t -76.0 -44.15 40.89 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.993 0.517 . . . . 0.0 110.451 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 87.5 t -68.57 -27.78 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.004 0.522 . . . . 0.0 110.229 177.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -69.89 -37.83 76.16 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.002 0.521 . . . . 0.0 110.706 173.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.22 -51.06 16.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.448 0.699 . . . . 0.0 111.74 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -89.28 -13.95 36.92 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 111.14 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.81 -20.71 70.23 Favored Glycine 0 C--N 1.349 1.255 0 CA-C-N 116.473 -0.33 . . . . 0.0 113.164 178.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.6 p -72.19 -10.87 60.36 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.915 0.486 . . . . 0.0 111.263 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.7 t -84.02 172.91 11.59 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.681 0.792 . . . . 0.0 110.179 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -148.29 24.94 1.01 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.782 0.833 . . . . 0.0 109.064 175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -73.94 83.0 1.71 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.589 0.756 . . . . 0.0 110.794 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 47.1 t -89.53 120.63 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.722 0.809 . . . . 0.0 110.617 -176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 68.3 mttm -93.04 113.54 25.83 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.392 1.077 . . . . 0.0 108.708 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.13 96.1 2.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.766 0.794 . . . . 0.0 109.938 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -92.27 -7.77 47.14 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.849 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.3 p -60.18 159.21 10.06 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.373 1.069 . . . . 0.0 111.178 172.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 98.82 19.69 21.34 Favored Glycine 0 N--CA 1.47 0.952 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.446 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 41.8 t -82.28 112.87 19.66 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.185 0.594 . . . . 0.0 109.695 174.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 . . . . . 0 C--O 1.25 1.117 0 C-N-CA 123.558 0.743 . . . . 0.0 109.021 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 112.174 -0.371 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.2 m -100.48 143.49 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.672 0.789 . . . . 0.0 109.945 175.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.8 pt -73.69 99.02 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-O 121.623 0.725 . . . . 0.0 109.513 173.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 56.2 mtm -81.6 96.5 7.5 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.792 -177.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.88 74.68 1.49 Allowed 'General case' 0 C--O 1.239 0.537 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 168.61 155.61 9.75 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 116.079 -0.509 . . . . 0.0 113.176 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -140.1 158.38 44.15 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.877 1.271 . . . . 0.0 109.526 -176.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.451 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 66.2 m-85 -98.85 146.94 25.43 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.636 0.775 . . . . 0.0 109.43 173.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -133.55 111.57 10.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.619 0.768 . . . . 0.0 109.122 174.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -80.3 95.94 6.49 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 173.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -104.27 -177.38 3.35 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.003 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 29' ' ' ASN . 22.0 ptmt -135.01 146.45 49.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.136 0.574 . . . . 0.0 109.657 174.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.4 m -78.12 169.72 17.8 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.54 0.736 . . . . 0.0 110.344 170.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.52 -10.98 59.12 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.101 0.56 . . . . 0.0 111.177 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -86.87 8.58 22.36 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.059 0.943 . . . . 0.0 111.569 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.504 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 42.3 m-80 69.46 7.94 6.5 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.482 1.513 . . . . 0.0 112.88 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HB2' HD12 ' A' ' 48' ' ' LEU . 11.6 mm-40 -84.74 137.59 33.12 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.001 0.52 . . . . 0.0 110.086 -178.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -91.72 134.05 35.06 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.978 0.911 . . . . 0.0 109.854 -172.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -152.87 141.26 20.65 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.625 0.77 . . . . 0.0 108.967 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -98.59 141.06 31.91 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 28.8 m -113.04 133.37 59.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 172.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.5 OUTLIER -88.0 108.04 19.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 167.645 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 4.3 ttmp? -111.54 114.86 28.22 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.155 0.982 . . . . 0.0 109.657 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.42 173.21 2.17 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.173 0.989 . . . . 0.0 112.602 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.15 -15.91 61.47 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.511 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -74.83 -6.06 46.95 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.059 0.944 . . . . 0.0 111.671 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.74 14.94 80.34 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -117.36 137.45 52.45 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.049 0.94 . . . . 0.0 109.97 -177.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 60.8 m -76.82 121.64 23.66 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.364 0.666 . . . . 0.0 110.401 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.5 pt -89.49 -19.84 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.008 0.923 . . . . 0.0 110.843 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 tp -159.89 118.37 2.73 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -172.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 55.4 m -111.31 127.35 55.61 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.457 0.703 . . . . 0.0 109.377 175.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.9 t -81.56 170.2 16.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.603 0.361 . . . . 0.0 111.13 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -83.22 -175.77 5.99 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.476 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.5 mm? -85.5 113.62 21.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.753 -172.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.435 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 75.8 m-85 -107.26 119.58 39.8 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.825 0.85 . . . . 0.0 108.721 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 81.4 p -61.71 -33.48 74.1 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.561 0.744 . . . . 0.0 111.644 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -113.75 135.8 53.55 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.095 0.958 . . . . 0.0 109.092 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.32 -28.15 67.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.452 0.701 . . . . 0.0 111.126 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.8 p -57.39 -36.21 70.98 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.074 0.95 . . . . 0.0 111.698 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 24.9 m -71.45 -28.85 64.25 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.252 0.621 . . . . 0.0 111.407 177.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.56 -32.11 57.96 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.608 0.763 . . . . 0.0 111.29 173.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -73.4 -34.07 65.32 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.597 0.759 . . . . 0.0 110.577 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -78.09 -26.34 48.06 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.701 170.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.39 -41.91 94.19 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.361 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.495 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -71.99 -32.41 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 175.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.22 -32.91 74.42 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.752 0.421 . . . . 0.0 110.738 172.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.2 m -69.3 -53.74 18.18 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.381 176.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.495 HG22 ' HA ' ' A' ' 59' ' ' ILE . 16.4 m -63.9 -29.1 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 123.047 0.217 . . . . 0.0 111.269 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -55.85 17.6 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.827 0.851 . . . . 0.0 108.728 178.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.9 t -66.52 -23.6 66.26 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.333 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.19 4.7 46.84 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.962 0.905 . . . . 0.0 112.28 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.1 m -66.76 -48.12 53.51 Favored Pre-proline 0 CA--C 1.565 1.531 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.254 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.95 -16.1 23.23 Favored 'Trans proline' 0 C--N 1.398 3.134 0 C-N-CA 121.814 1.676 . . . . 0.0 112.728 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -84.63 99.84 11.05 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.211 0.604 . . . . 0.0 110.394 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.67 -23.42 65.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.929 0.891 . . . . 0.0 112.535 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -73.3 -30.18 63.21 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.149 0.979 . . . . 0.0 110.615 -176.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -75.97 -12.04 60.07 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.41 0.684 . . . . 0.0 112.055 -171.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -129.17 145.77 51.24 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.579 0.351 . . . . 0.0 110.282 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.424 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 36.8 tt0 -130.7 147.24 52.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.531 0.732 . . . . 0.0 109.875 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.06 112.57 5.76 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 74.7 mmtt -111.9 142.04 44.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.666 0.787 . . . . 0.0 111.459 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 55.4 m -123.55 117.63 25.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.452 0.701 . . . . 0.0 109.352 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.04 168.4 6.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.375 1.07 . . . . 0.0 112.232 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.3 m -64.56 -24.45 67.6 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.223 1.009 . . . . 0.0 112.079 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.47 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 14.7 m120 -89.21 9.78 24.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 0.0 111.337 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.0 5.43 89.74 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 116.499 -0.318 . . . . 0.0 113.326 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 73.2 mmtt -73.36 152.56 40.82 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.473 0.709 . . . . 0.0 110.311 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 92.7 m-85 -113.27 126.73 55.73 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.303 0.641 . . . . 0.0 109.989 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.83 -179.92 8.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.066 1.346 . . . . 0.0 108.295 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -139.38 172.26 13.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.989 -0.444 . . . . 0.0 109.948 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -145.31 141.9 28.96 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.669 0.388 . . . . 0.0 110.489 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.59 140.11 31.69 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.929 0.892 . . . . 0.0 109.214 177.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -121.78 158.83 27.96 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.66 1.584 . . . . 0.0 110.247 -172.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -128.63 -176.48 3.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.831 0.852 . . . . 0.0 110.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.44 -22.02 66.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.721 0.808 . . . . 0.0 111.625 175.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -73.24 -16.72 61.4 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.522 1.129 . . . . 0.0 111.315 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 m80 67.15 14.68 9.86 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.324 1.45 . . . . 0.0 111.025 -167.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -88.36 161.76 16.93 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.493 0.717 . . . . 0.0 110.269 177.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.3 mm -84.66 104.08 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.948 -1.023 . . . . 0.0 108.352 174.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.84 -2.33 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.005 0.522 . . . . 0.0 110.471 173.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.59 146.49 8.88 Favored Glycine 0 C--N 1.341 0.851 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.3 p -156.61 123.48 5.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.173 0.989 . . . . 0.0 108.761 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.9 m -72.43 171.89 11.44 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.315 1.046 . . . . 0.0 112.649 -171.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.41 150.7 38.26 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 171.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.62 115.27 12.83 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -100.66 150.34 22.84 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.65 -31.91 52.94 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.388 0.275 . . . . 0.0 110.971 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.3 p -110.81 148.7 31.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.065 0.546 . . . . 0.0 111.778 -174.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.32 -24.4 61.3 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.421 1.089 . . . . 0.0 112.353 -175.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -68.78 -32.91 72.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.276 0.631 . . . . 0.0 111.54 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.5 m -68.76 -31.38 70.37 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.015 0.526 . . . . 0.0 112.368 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.413 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 38.6 ptt180 -75.99 -39.75 55.19 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 117.421 0.101 . . . . 0.0 110.875 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -76.91 -28.64 55.39 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -66.41 -38.4 87.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 168.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.35 -37.06 92.49 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.748 174.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.9 mm -59.39 -51.44 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.546 0.739 . . . . 0.0 109.572 174.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.79 68.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.671 0.789 . . . . 0.0 111.353 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.3 t -75.52 -33.81 60.75 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.897 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.1 t -70.45 -35.05 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 122.971 0.508 . . . . 0.0 110.235 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -67.53 -34.27 76.74 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.564 0.746 . . . . 0.0 111.053 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -50.17 8.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.167 0.587 . . . . 0.0 111.294 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -89.22 -1.77 58.21 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.695 0.798 . . . . 0.0 112.208 -170.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.07 -25.12 76.3 Favored Glycine 0 C--N 1.339 0.721 0 CA-C-O 120.144 -0.254 . . . . 0.0 112.747 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.3 t -89.28 -5.96 57.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.481 0.712 . . . . 0.0 111.38 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.0 m -66.03 143.21 57.5 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.956 0.502 . . . . 0.0 110.684 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -111.65 8.21 20.73 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.624 0.769 . . . . 0.0 110.742 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 23.4 m -77.38 91.62 3.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.866 0.867 . . . . 0.0 110.792 -175.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.6 t -104.24 113.05 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.609 0.764 . . . . 0.0 109.827 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 43.8 mtpt -101.38 110.27 22.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.583 0.753 . . . . 0.0 109.905 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -76.82 94.45 3.88 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-O 122.149 0.976 . . . . 0.0 110.094 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -95.25 7.79 45.08 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 110.707 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.5 p -62.65 92.43 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.715 0.806 . . . . 0.0 111.344 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.63 -24.09 10.58 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.109 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 t -73.66 88.68 1.72 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.599 0.76 . . . . 0.0 110.053 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.5 m120 . . . . . 0 C--O 1.25 1.082 0 C-N-CA 124.752 1.221 . . . . 0.0 108.562 -179.219 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.579 0 N-CA-C 112.001 -0.439 . . . . 0.0 112.001 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -83.5 142.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.126 0.57 . . . . 0.0 110.513 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.1 pt -104.42 127.84 58.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 CA-C-O 121.279 0.561 . . . . 0.0 109.497 175.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 56.7 mtt -85.31 97.57 10.03 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.487 0.715 . . . . 0.0 110.428 -172.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.2 88.23 5.53 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.145 0.978 . . . . 0.0 109.023 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.03 147.56 22.11 Favored Glycine 0 C--N 1.34 0.762 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -170.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -159.72 153.79 23.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.469 0.708 . . . . 0.0 110.276 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -100.03 152.09 20.62 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.932 173.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -133.08 114.66 14.17 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.872 0.869 . . . . 0.0 109.18 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 52' ' ' LYS . 40.8 tp -80.5 98.32 7.52 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -102.45 179.5 4.28 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.448 1.099 . . . . 0.0 109.306 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HE3' ' H ' ' A' ' 127' ' ' GLY . 22.5 pttp -146.48 145.07 30.06 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 168.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.3 m -81.45 -173.35 4.32 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.279 0.632 . . . . 0.0 111.422 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -63.06 -22.6 66.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.799 0.84 . . . . 0.0 111.115 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.26 -16.74 61.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.501 1.12 . . . . 0.0 111.95 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 71.58 11.27 6.49 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.543 1.537 . . . . 0.0 111.795 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.14 138.09 35.91 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.526 0.73 . . . . 0.0 109.102 174.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -89.57 138.36 31.53 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 110.33 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -149.5 130.89 14.71 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.118 0.967 . . . . 0.0 108.99 -168.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -90.77 143.49 26.68 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.77 131.64 71.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 166.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.26 110.18 22.41 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -98.39 123.51 42.56 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 171.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.4 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.96 178.87 0.75 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.578 0.751 . . . . 0.0 111.478 176.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.91 -20.83 54.35 Favored Glycine 0 CA--C 1.54 1.65 0 CA-C-O 121.105 0.28 . . . . 0.0 112.652 172.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.82 -23.29 65.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.367 1.467 . . . . 0.0 111.993 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.16 -3.86 82.58 Favored Glycine 0 C--N 1.35 1.31 0 C-N-CA 123.307 0.48 . . . . 0.0 112.521 -173.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -88.28 134.08 33.89 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.775 1.23 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -71.85 120.53 17.58 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.4 HD13 ' HB2' ' A' ' 37' ' ' ALA . 28.3 pt -108.3 -25.55 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 125.041 1.337 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.423 HD13 HG21 ' A' ' 113' ' ' VAL . 16.4 tp -140.32 151.42 45.03 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.286 1.034 . . . . 0.0 108.552 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.0 m -151.01 110.62 4.02 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.097 0.959 . . . . 0.0 108.649 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.448 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 18.8 m -63.57 165.32 8.22 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.314 0.646 . . . . 0.0 110.942 175.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.96 179.82 4.71 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.283 0.563 . . . . 0.0 111.414 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.74 114.75 22.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -106.17 142.39 35.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.197 0.999 . . . . 0.0 109.384 -178.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.0 t -65.52 -26.72 68.03 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.407 0.683 . . . . 0.0 111.454 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -139.41 150.42 45.24 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.01 0.924 . . . . 0.0 109.559 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.601 ' HB2' HD21 ' A' ' 23' ' ' LEU . 20.3 pttm -62.67 -26.57 68.72 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.613 0.571 . . . . 0.0 110.841 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.439 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 82.1 p -50.97 -47.36 61.31 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.091 1.357 . . . . 0.0 112.122 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.2 m -71.71 -26.63 62.57 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.74 . . . . 0.0 111.552 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.75 63.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.616 0.767 . . . . 0.0 110.23 174.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.83 -37.82 76.34 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.097 0.959 . . . . 0.0 110.206 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 53' ' ' THR . 29.2 mtpp -66.47 -33.53 75.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.608 170.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.06 -49.78 74.62 Favored Glycine 0 C--N 1.35 1.339 0 O-C-N 124.071 0.857 . . . . 0.0 112.762 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.508 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -70.42 -36.11 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 117.15 0.475 . . . . 0.0 110.9 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.54 -39.33 79.9 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.114 0.483 . . . . 0.0 110.301 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.1 m -74.47 -43.28 56.82 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.858 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.508 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -66.1 -28.79 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 119.11 0.868 . . . . 0.0 110.319 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.4 tpt85 -68.16 -39.23 82.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.678 0.791 . . . . 0.0 109.869 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.7 m -78.35 -24.05 46.65 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.691 0.796 . . . . 0.0 111.509 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -105.32 13.69 30.02 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.107 0.963 . . . . 0.0 111.21 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.9 m -55.93 -45.36 99.91 Favored Pre-proline 0 CA--C 1.569 1.676 0 C-N-CA 123.591 0.756 . . . . 0.0 112.148 172.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -87.93 -14.09 3.63 Favored 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 121.796 1.664 . . . . 0.0 113.951 175.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.38 93.12 4.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.033 0.533 . . . . 0.0 110.769 -170.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.09 -32.37 72.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.948 1.299 . . . . 0.0 112.565 -173.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -68.85 -26.04 64.95 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.551 0.74 . . . . 0.0 111.041 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -77.06 -26.05 53.13 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.572 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.468 ' HB3' HD12 ' A' ' 110' ' ' ILE . 95.9 m-85 -82.58 97.12 8.31 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 171.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -110.28 146.42 35.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.83 0.452 . . . . 0.0 109.888 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -87.01 149.32 24.84 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.798 1.239 . . . . 0.0 109.469 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -155.77 129.15 8.28 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.209 0.603 . . . . 0.0 109.857 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 48.2 m -92.27 121.42 33.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.954 0.502 . . . . 0.0 109.658 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 160.98 6.24 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.248 1.019 . . . . 0.0 111.908 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.2 t -72.37 -9.99 59.21 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.803 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -72.44 -10.32 59.65 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.744 0.818 . . . . 0.0 111.199 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.47 -6.05 84.02 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.35 0.5 . . . . 0.0 112.523 -175.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -92.28 159.15 15.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.735 0.814 . . . . 0.0 110.333 -174.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -105.75 128.89 53.97 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 -166.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.48 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 26.5 p90 -139.2 177.83 7.62 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -123.76 171.27 9.75 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.086 0.47 . . . . 0.0 110.07 176.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -148.08 121.78 9.24 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 124.154 0.981 . . . . 0.0 108.434 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.536 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -83.64 97.99 9.38 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -84.46 145.7 28.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.324 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -110.99 170.78 7.87 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.624 0.769 . . . . 0.0 110.839 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.29 -9.4 53.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.889 0.876 . . . . 0.0 111.673 173.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -88.01 6.26 36.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.229 1.011 . . . . 0.0 111.883 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 77.4 m80 69.92 -2.74 1.93 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 125.058 1.343 . . . . 0.0 112.34 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -99.06 150.98 21.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.432 0.693 . . . . 0.0 109.626 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.599 HG21 ' HB3' ' A' ' 96' ' ' SER . 50.4 mt -87.52 108.92 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 173.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.536 HD11 HD22 ' A' ' 86' ' ' LEU . 9.9 pt -79.32 -5.83 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.729 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . 178.67 113.91 0.39 Allowed Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 173.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.599 ' HB3' HG21 ' A' ' 93' ' ' ILE . 52.5 p -112.33 151.22 29.98 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.917 0.858 . . . . 0.0 109.743 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.9 t -81.11 166.49 20.65 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.31 -78.02 0.15 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.15 0.58 . . . . 0.0 109.87 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.48 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 23.3 ptm -175.75 122.51 0.19 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.283 1.033 . . . . 0.0 108.943 -176.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -102.97 115.86 31.43 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.97 90.9 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.039 0.536 . . . . 0.0 110.207 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.0 p -90.23 120.05 31.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.847 0.859 . . . . 0.0 109.226 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -24.64 65.9 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.207 1.003 . . . . 0.0 113.114 -171.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.94 -29.39 69.8 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.239 0.616 . . . . 0.0 111.868 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.8 m -71.77 -21.22 61.76 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.871 0.868 . . . . 0.0 111.417 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.72 -40.64 88.48 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.486 0.714 . . . . 0.0 109.529 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.86 -47.38 85.3 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.359 1.063 . . . . 0.0 110.919 174.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.1 m -60.75 -36.52 79.11 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.193 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -62.44 -42.53 99.7 Favored Glycine 0 C--N 1.35 1.311 0 O-C-N 123.627 0.58 . . . . 0.0 112.881 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.468 HD12 ' HB3' ' A' ' 72' ' ' TYR . 32.5 mm -58.09 -47.1 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.197 0.599 . . . . 0.0 110.145 175.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.87 -32.3 72.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.207 1.003 . . . . 0.0 111.602 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.0 t -74.2 -41.53 61.25 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.274 0.63 . . . . 0.0 110.306 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.423 HG21 HD13 ' A' ' 44' ' ' LEU . 94.1 t -75.91 -26.34 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.192 0.597 . . . . 0.0 110.684 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -64.41 -39.79 94.52 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.204 0.602 . . . . 0.0 109.845 169.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.1 -47.02 21.61 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.128 0.971 . . . . 0.0 111.878 -177.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -101.58 -2.72 29.85 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.674 0.79 . . . . 0.0 112.195 -170.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -75.91 -8.88 85.12 Favored Glycine 0 N--CA 1.475 1.287 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 82.7 p -80.25 -12.84 59.58 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.28 1.032 . . . . 0.0 111.567 174.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.8 m -69.97 118.23 12.55 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.904 0.882 . . . . 0.0 110.733 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -82.94 -17.71 42.65 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.409 0.683 . . . . 0.0 110.766 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.4 m -61.93 92.62 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.942 0.897 . . . . 0.0 112.425 -174.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 84.0 t -88.53 101.39 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.688 170.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -87.21 143.78 27.13 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 169.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -104.73 138.77 40.52 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.278 0.561 . . . . 0.0 110.819 -178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -129.94 -2.31 4.65 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.736 1.214 . . . . 0.0 109.912 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 37.1 p -70.32 131.47 44.19 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLY . . . . . 0.425 ' H ' ' HE3' ' A' ' 25' ' ' LYS . . . 81.6 14.73 77.52 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-O 119.647 -0.529 . . . . 0.0 112.855 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.8 t -67.78 132.48 47.51 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.9 p30 . . . . . 0 CA--C 1.558 1.268 0 C-N-CA 123.326 0.651 . . . . 0.0 111.406 -173.61 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.408 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.9 m -72.96 153.89 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.156 0.582 . . . . 0.0 110.542 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.2 pt -79.24 156.94 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 122.961 0.504 . . . . 0.0 110.817 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.7 mmt -74.9 98.8 3.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.14 96.98 4.61 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.534 0.734 . . . . 0.0 109.938 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.92 168.83 26.57 Favored Glycine 0 C--N 1.342 0.864 0 O-C-N 123.682 0.614 . . . . 0.0 112.136 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.468 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.2 p90 -154.76 168.84 25.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.677 0.791 . . . . 0.0 111.103 -171.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 46.1 m-85 -110.57 148.8 31.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.67 1.188 . . . . 0.0 108.438 172.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 39.3 mt-10 -133.39 111.28 10.64 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 171.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 31' ' ' PHE . 26.9 tp -83.37 100.29 10.59 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.417 0.627 . . . . 0.0 109.606 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m -93.83 178.41 5.68 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.688 1.195 . . . . 0.0 110.051 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -130.37 163.13 27.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.554 0.742 . . . . 0.0 109.442 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -120.98 -169.46 1.84 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.763 0.825 . . . . 0.0 110.523 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.0 m -63.46 -30.43 71.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.96 0.904 . . . . 0.0 112.657 -170.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -89.0 12.51 15.27 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.146 0.578 . . . . 0.0 111.267 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.6 t30 63.36 20.91 12.53 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.046 1.339 . . . . 0.0 110.48 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -87.23 142.08 28.17 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.732 0.813 . . . . 0.0 110.169 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.491 ' HB3' HD11 ' A' ' 23' ' ' LEU . 79.7 m-85 -90.96 130.71 36.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.905 1.282 . . . . 0.0 110.742 -165.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 46' ' ' SER . 47.5 ttm-85 -134.88 127.34 30.52 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.749 1.22 . . . . 0.0 108.611 -174.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.97 135.16 33.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.5 m -113.96 131.31 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 165.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.428 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.6 OUTLIER -104.56 115.66 30.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -113.92 138.88 49.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.506 0.722 . . . . 0.0 109.684 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 174.4 11.63 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.217 0.607 . . . . 0.0 109.941 170.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.84 -14.78 68.25 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.972 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -70.8 -11.56 61.03 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.722 1.209 . . . . 0.0 111.478 174.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 88.4 0.5 82.32 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.908 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -96.42 141.73 29.37 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.699 0.799 . . . . 0.0 110.997 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.4 m -79.1 119.89 22.86 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.011 0.819 . . . . 0.0 109.335 175.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.403 HD11 HD22 ' A' ' 35' ' ' LEU . 26.2 pt -92.35 -30.53 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.271 1.028 . . . . 0.0 111.106 -178.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.4 tp -148.55 150.59 33.62 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.808 0.843 . . . . 0.0 109.131 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.474 HG22 HH11 ' A' ' 32' ' ' ARG . 55.6 m -136.31 109.92 8.03 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.493 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 13.2 m -66.83 153.3 43.75 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.449 0.7 . . . . 0.0 109.682 173.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -82.89 -167.91 1.84 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.117 0.567 . . . . 0.0 112.195 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.18 145.21 37.8 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.464 0.706 . . . . 0.0 111.731 -173.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 96.2 m-85 -134.65 133.61 40.29 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.35 1.46 . . . . 0.0 107.732 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.4 m -61.39 -36.94 81.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.123 0.569 . . . . 0.0 110.707 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.6 m -126.31 150.68 48.34 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.333 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -67.99 -24.51 65.14 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.349 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -62.17 -36.34 81.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.45 0.7 . . . . 0.0 111.464 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.7 m -69.63 -35.38 75.18 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.229 0.612 . . . . 0.0 109.974 173.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.0 69.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.778 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -67.84 -34.82 77.45 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.25 0.62 . . . . 0.0 110.303 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -67.14 -35.88 80.67 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.099 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.21 -49.33 71.97 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 123.925 0.766 . . . . 0.0 113.337 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.5 tt -67.74 -33.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 116.961 0.38 . . . . 0.0 111.008 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.19 -37.61 87.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.845 0.458 . . . . 0.0 110.406 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.9 m -74.41 -39.5 62.61 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.029 -178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 20.2 m -67.23 -33.41 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.774 0.715 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -73.91 -35.16 64.6 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.894 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.6 t -76.25 -21.48 56.29 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.522 0.729 . . . . 0.0 110.673 176.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.565 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 0.9 OUTLIER -95.06 8.33 43.3 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.917 0.887 . . . . 0.0 110.885 176.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 39.8 t -67.49 -47.45 47.15 Favored Pre-proline 0 CA--C 1.572 1.819 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.397 171.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.93 -26.37 26.83 Favored 'Trans proline' 0 C--N 1.4 3.263 0 C-N-CA 121.957 1.771 . . . . 0.0 112.142 168.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 65' ' ' ASN . 12.0 mm100 -92.55 46.69 1.26 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.899 0.88 . . . . 0.0 109.191 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -67.44 -13.02 61.65 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -73.37 -26.04 60.84 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.786 0.834 . . . . 0.0 110.562 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.44 HH21 ' HG2' ' A' ' 73' ' ' GLU . 3.6 tpm_? -70.78 -16.29 62.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.899 0.88 . . . . 0.0 112.269 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -63.46 122.48 16.37 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 168.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HG2' HH21 ' A' ' 71' ' ' ARG . 38.0 mt-10 -94.6 110.92 22.7 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -172.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.03 104.31 1.11 Allowed 'General case' 0 C--N 1.353 0.741 0 O-C-N 123.9 0.75 . . . . 0.0 110.062 -178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -95.37 143.93 26.33 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.664 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.5 m -127.24 115.43 19.03 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.74 155.48 37.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.674 0.79 . . . . 0.0 110.573 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -68.63 -13.12 62.14 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.53 0.732 . . . . 0.0 110.685 175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -77.31 4.65 10.22 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.024 0.929 . . . . 0.0 111.713 172.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.21 17.86 77.67 Favored Glycine 0 C--N 1.351 1.413 0 C-N-CA 122.885 0.278 . . . . 0.0 113.089 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -104.7 125.8 51.15 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.831 0.852 . . . . 0.0 110.274 -176.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -79.7 137.42 37.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 172.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -150.83 176.81 10.71 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -138.21 140.82 39.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 122.048 -0.408 . . . . 0.0 110.483 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -110.74 114.34 27.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 171.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -80.73 125.29 29.87 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -109.58 138.99 45.13 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.071 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.22 161.81 13.95 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.44 0.696 . . . . 0.0 110.685 175.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.72 69.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.921 0.888 . . . . 0.0 111.323 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.41 12.26 3.81 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.555 1.142 . . . . 0.0 112.539 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 66.35 14.11 9.53 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.853 1.261 . . . . 0.0 111.677 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -88.9 128.85 35.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.494 0.718 . . . . 0.0 109.135 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.8 96.91 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.7 pt -83.46 -7.07 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.081 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -162.59 145.18 10.36 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 173.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.9 p -155.45 118.78 4.4 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.3 t -81.76 164.42 21.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 122.758 0.423 . . . . 0.0 110.615 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -75.02 -84.59 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.119 0.568 . . . . 0.0 110.085 -176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 12.7 ptp -164.55 129.73 2.74 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.975 0.91 . . . . 0.0 109.504 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 81.0 m-85 -104.25 131.76 51.22 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.649 0.78 . . . . 0.0 109.719 173.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.37 -31.37 72.02 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.958 0.903 . . . . 0.0 111.645 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 17.5 p -140.81 165.64 26.96 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.976 0.91 . . . . 0.0 110.557 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -30.7 69.53 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.399 1.08 . . . . 0.0 112.065 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -61.11 -37.44 82.8 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 123.953 0.783 . . . . 0.0 111.385 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.485 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 21.5 m -74.58 -30.78 61.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.01 0.924 . . . . 0.0 110.569 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -39.4 88.69 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.085 0.954 . . . . 0.0 110.089 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.43 -36.93 77.14 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.795 0.838 . . . . 0.0 110.71 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.0 m -62.86 -37.63 87.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.529 0.732 . . . . 0.0 109.482 172.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.432 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.92 -48.56 82.84 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.427 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.0 mm -55.23 -50.01 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.331 0.652 . . . . 0.0 110.095 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.69 -39.35 84.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 13.7 t -76.15 -36.01 58.95 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.86 -175.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 109' ' ' GLY . 85.5 t -71.16 -31.9 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 118.141 0.428 . . . . 0.0 110.198 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -69.23 -43.37 74.19 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.633 0.373 . . . . 0.0 110.766 174.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.71 -48.15 56.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.565 0.746 . . . . 0.0 111.327 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -88.8 -10.54 47.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.874 0.87 . . . . 0.0 111.576 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.44 -37.15 89.93 Favored Glycine 0 C--N 1.346 1.136 0 O-C-N 123.245 0.341 . . . . 0.0 112.785 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.1 t -75.78 -11.14 59.93 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.934 0.894 . . . . 0.0 112.239 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.2 m -69.5 104.56 2.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.179 0.592 . . . . 0.0 110.135 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -86.28 72.47 10.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.222 1.011 . . . . 0.0 108.802 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.468 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.1 t -145.42 93.83 2.43 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.041 -1.436 . . . . 0.0 108.898 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.2 t -109.24 123.79 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.974 0.91 . . . . 0.0 110.542 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -100.7 90.26 4.18 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 174.289 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.94 97.16 1.8 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.405 ' ND2' ' HB3' ' A' ' 22' ' ' GLU . 87.2 m-20 -84.54 -4.12 58.79 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.561 1.144 . . . . 0.0 112.445 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.416 HG21 ' HD1' ' A' ' 31' ' ' PHE . 47.3 p -68.53 153.28 44.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.315 0.646 . . . . 0.0 111.202 -176.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 102.96 -19.44 46.7 Favored Glycine 0 N--CA 1.472 1.093 0 CA-C-O 119.958 -0.357 . . . . 0.0 112.442 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 34.7 p -78.5 127.12 31.71 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.159 0.583 . . . . 0.0 110.016 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.7 m120 . . . . . 0 C--O 1.251 1.158 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -177.011 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.2 m -112.33 156.57 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.05 0.94 . . . . 0.0 109.448 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.4 pt -85.1 139.99 16.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 63.1 mtt -88.78 106.2 18.21 Favored 'General case' 0 C--O 1.245 0.824 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.73 82.3 2.7 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.228 -0.896 . . . . 0.0 108.868 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.0 154.5 30.6 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.92 -172.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.2 p90 -159.05 150.13 20.12 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.799 0.839 . . . . 0.0 109.88 -178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -90.57 157.48 17.49 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.607 0.763 . . . . 0.0 109.56 172.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.477 ' HA ' ' HB3' ' A' ' 123' ' ' LYS . 55.3 mt-10 -136.09 110.49 8.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.69 0.796 . . . . 0.0 109.565 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.457 HD21 ' HG3' ' A' ' 52' ' ' LYS . 29.2 tp -94.18 101.68 13.68 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.197 0.599 . . . . 0.0 109.849 -178.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.551 ' HA ' ' HB3' ' A' ' 125' ' ' ASN . 22.3 m -107.04 174.49 5.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.239 1.016 . . . . 0.0 110.702 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.39 151.65 36.59 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.199 0.999 . . . . 0.0 109.58 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.8 m -89.43 -177.65 5.39 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.771 0.829 . . . . 0.0 111.428 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.6 t -61.92 -34.82 76.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.952 0.901 . . . . 0.0 110.943 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.38 11.52 36.33 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.782 0.833 . . . . 0.0 111.078 176.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 t30 69.42 33.78 3.06 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 125.349 1.46 . . . . 0.0 112.559 174.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -81.12 139.27 35.73 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 121.748 -0.595 . . . . 0.0 110.027 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -90.16 117.47 28.95 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.393 1.077 . . . . 0.0 109.485 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -130.18 119.29 22.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.062 0.945 . . . . 0.0 109.264 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -95.24 130.54 41.94 Favored 'General case' 0 C--O 1.241 0.615 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 45' ' ' THR . 20.7 m -106.12 170.75 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 170.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.2 125.27 42.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -112.81 138.81 49.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.97 178.49 1.78 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.454 0.702 . . . . 0.0 111.305 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -19.86 61.46 Favored Glycine 0 C--N 1.35 1.327 0 CA-C-N 116.585 -0.28 . . . . 0.0 113.031 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -67.8 -24.35 65.29 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.598 0.759 . . . . 0.0 111.779 173.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.37 15.5 58.58 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 116.537 -0.302 . . . . 0.0 113.025 -175.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -106.77 141.46 37.98 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.421 0.689 . . . . 0.0 110.317 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.9 m -67.77 122.29 17.79 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 123.602 0.564 . . . . 0.0 110.861 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.5 pt -109.85 -18.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.775 1.23 . . . . 0.0 110.651 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 tp -151.06 145.94 25.84 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.498 HG23 HG12 ' A' ' 34' ' ' VAL . 92.5 m -146.4 119.06 8.56 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.842 0.857 . . . . 0.0 108.813 178.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -82.0 177.26 8.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.919 0.487 . . . . 0.0 111.335 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -73.22 175.43 6.82 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.346 1.059 . . . . 0.0 111.725 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.0 114.65 27.25 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.414 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -99.56 147.33 25.45 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.069 0.948 . . . . 0.0 109.323 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.6 p -81.09 -31.99 34.1 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.83 0.452 . . . . 0.0 111.297 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.2 m -109.15 143.7 38.2 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.953 0.901 . . . . 0.0 109.703 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HG3' HD21 ' A' ' 23' ' ' LEU . 87.3 tttt -67.93 -37.89 82.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.978 0.511 . . . . 0.0 110.412 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.172 0.989 . . . . 0.0 111.695 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 m -64.12 -39.2 93.52 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.072 0.949 . . . . 0.0 111.25 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.97 -34.67 66.61 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.578 0.751 . . . . 0.0 110.886 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.94 -29.63 65.71 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.575 0.75 . . . . 0.0 111.1 177.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -77.96 -27.41 49.23 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.322 0.249 . . . . 0.0 111.275 170.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.85 -40.84 99.37 Favored Glycine 0 C--N 1.344 1.002 0 O-C-N 123.525 0.516 . . . . 0.0 112.827 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.449 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.4 tt -68.01 -32.82 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 120.91 0.386 . . . . 0.0 111.067 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.17 74.15 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.071 0.548 . . . . 0.0 110.677 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -70.84 -50.83 31.11 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.879 0.871 . . . . 0.0 111.344 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 59' ' ' ILE . 30.7 m -66.18 -28.84 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.293 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -53.16 -50.97 63.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.681 0.793 . . . . 0.0 110.334 -178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -80.79 -31.99 35.54 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.826 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB3' HD11 ' A' ' 86' ' ' LEU . 14.1 m120 -96.06 -8.4 33.6 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 p -65.28 -37.02 17.24 Favored Pre-proline 0 CA--C 1.566 1.584 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -74.13 -7.9 20.37 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.768 1.645 . . . . 0.0 112.993 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.79 88.93 4.44 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 122.923 0.489 . . . . 0.0 109.768 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.458 ' HA ' ' HD1' ' A' ' 72' ' ' TYR . 12.2 pt-20 -62.02 -20.19 63.65 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.801 0.84 . . . . 0.0 111.685 176.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -54.3 -40.74 68.2 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.457 1.103 . . . . 0.0 112.044 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -83.69 -9.43 58.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.514 0.726 . . . . 0.0 112.095 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 85' ' ' ASN . 88.8 m-85 -84.01 124.65 31.28 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.445 ' HB2' ' ND2' ' A' ' 85' ' ' ASN . 41.9 mt-10 -95.5 104.11 16.0 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 173.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -73.14 101.77 3.41 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.731 0.777 . . . . 0.0 109.136 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HE2' ' ND2' ' A' ' 85' ' ' ASN . 65.9 mttm -102.57 165.05 11.31 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.513 1.125 . . . . 0.0 109.937 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.8 m -126.3 112.2 15.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.312 0.645 . . . . 0.0 109.605 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.0 165.54 6.8 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.841 0.856 . . . . 0.0 111.02 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -64.3 -16.31 61.92 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.585 0.754 . . . . 0.0 111.98 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -81.35 -2.05 47.75 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.956 0.902 . . . . 0.0 111.986 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 77.94 14.97 81.76 Favored Glycine 0 C--N 1.349 1.27 0 C-N-CA 122.831 0.253 . . . . 0.0 112.935 -176.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.64 142.68 29.15 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.886 0.874 . . . . 0.0 109.535 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -101.23 125.48 47.86 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.865 0.466 . . . . 0.0 109.832 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.454 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 35.7 p90 -131.74 170.54 14.67 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.505 ' HB2' ' HB3' ' A' ' 97' ' ' SER . 16.6 m-85 -131.22 166.89 20.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.942 0.497 . . . . 0.0 110.142 -173.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.558 ' ND2' ' HE2' ' A' ' 75' ' ' LYS . 4.0 p30 -149.77 133.06 16.45 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 167.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 65' ' ' ASN . 27.2 tp -89.78 116.24 27.73 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -96.88 140.47 31.39 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.933 -176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -98.15 166.04 11.6 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.826 0.85 . . . . 0.0 109.748 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.07 -13.84 62.32 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.088 0.555 . . . . 0.0 111.634 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.478 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 64.4 m-20 -80.1 4.1 18.34 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.816 0.847 . . . . 0.0 111.296 174.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 74.3 m80 67.25 15.46 9.99 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.02 1.328 . . . . 0.0 111.788 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.478 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 13.4 pt20 -97.67 147.02 24.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.194 0.598 . . . . 0.0 110.426 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.96 99.72 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 13.0 pt -81.22 -16.51 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.756 -177.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.83 103.26 0.2 Allowed Glycine 0 C--N 1.35 1.335 0 C-N-CA 121.701 -0.285 . . . . 0.0 113.046 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 85' ' ' ASN . 39.8 t -92.86 113.56 25.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.661 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.505 ' HB3' ' HB2' ' A' ' 84' ' ' PHE . 46.6 t -81.8 135.85 35.43 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -75.43 172.5 12.4 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.454 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.07 118.08 16.6 Favored 'General case' 0 C--N 1.351 0.651 0 CA-C-O 121.801 0.81 . . . . 0.0 112.045 -171.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -93.95 137.09 33.55 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.485 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.16 -56.51 4.58 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.259 0.624 . . . . 0.0 110.818 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.3 p -88.26 151.68 22.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.511 0.724 . . . . 0.0 112.241 -171.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.91 -24.84 60.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.407 1.083 . . . . 0.0 111.973 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -65.81 -37.56 86.58 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.5 m -74.75 -18.59 60.47 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.249 1.02 . . . . 0.0 111.816 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -60.75 -48.95 79.46 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 173.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.7 -48.13 23.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.958 0.903 . . . . 0.0 111.043 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.8 m -61.38 -28.72 69.44 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.704 0.802 . . . . 0.0 111.265 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.449 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -66.26 -51.65 42.22 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.744 178.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.7 mm -65.48 -38.07 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 122.843 0.457 . . . . 0.0 110.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -30.57 71.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.961 0.904 . . . . 0.0 111.486 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.91 -50.08 18.08 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 109' ' ' GLY . 66.2 t -62.17 -36.63 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 C-N-CA 122.972 0.509 . . . . 0.0 111.778 -175.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -69.95 -39.44 76.03 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 120.705 0.288 . . . . 0.0 111.337 178.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.48 -41.57 46.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.326 0.651 . . . . 0.0 111.434 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -91.08 -10.77 40.84 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.5 0.72 . . . . 0.0 110.782 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.22 -12.46 84.58 Favored Glycine 0 C--N 1.354 1.542 0 C-N-CA 122.842 0.258 . . . . 0.0 113.572 177.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.2 p -81.92 -18.31 44.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.259 0.623 . . . . 0.0 111.016 172.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.3 m -76.06 90.34 3.04 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 123.449 0.7 . . . . 0.0 110.046 -178.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.446 ' HA ' HD11 ' A' ' 59' ' ' ILE . 22.7 mm-40 -82.93 67.75 9.14 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 122.185 0.993 . . . . 0.0 109.597 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.6 t -136.65 93.3 2.85 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.0 -1.454 . . . . 0.0 109.244 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 35.4 m -85.93 141.4 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.183 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.477 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 55.5 tptt -97.07 99.3 10.81 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 174.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.85 95.24 1.91 Allowed 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.134 -175.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 24' ' ' SER . 26.5 t-20 -79.06 -26.64 43.05 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 165.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 75.1 p -59.83 137.24 58.11 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.35 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 99.18 -19.65 53.23 Favored Glycine 0 CA--C 1.531 1.047 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.932 -174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.1 m -77.9 162.85 26.51 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.24 0.616 . . . . 0.0 111.385 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.632 -0.699 . . . . 0.0 109.575 179.19 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.379 0 N-CA-C 112.097 -0.401 . . . . 0.0 112.097 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.59 140.85 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.136 0.575 . . . . 0.0 110.138 176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.3 pt -73.11 138.35 21.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 51.8 mtt -70.08 96.12 1.03 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.65 92.92 4.84 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.536 -172.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.29 151.11 9.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.74 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -147.65 148.32 30.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.038 0.935 . . . . 0.0 109.936 -176.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -97.17 118.83 34.48 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -95.58 109.02 21.32 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.61 HD21 ' HB2' ' A' ' 52' ' ' LYS . 49.4 tp -79.72 101.47 8.43 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -103.52 139.8 38.37 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.922 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 126' ' ' THR . 14.8 ptmm? -95.44 130.13 42.36 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 170.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.4 m -83.98 -178.49 6.99 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 109.882 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -59.94 -25.76 65.42 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.066 0.546 . . . . 0.0 112.259 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -102.31 25.71 8.61 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.848 0.859 . . . . 0.0 111.086 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 63.88 12.18 6.58 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 125.035 1.334 . . . . 0.0 112.829 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -69.44 126.25 29.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.344 0.658 . . . . 0.0 110.941 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.48 119.95 30.37 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.195 0.998 . . . . 0.0 109.475 -170.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HB2' HD13 ' A' ' 48' ' ' LEU . 47.2 ttp85 -147.9 117.78 7.17 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.837 0.855 . . . . 0.0 108.972 -173.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -90.99 128.08 36.67 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 45' ' ' THR . 30.5 m -107.06 130.89 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.694 0.797 . . . . 0.0 108.892 173.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.2 tp -89.77 112.93 24.37 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -105.29 129.29 53.68 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.305 1.042 . . . . 0.0 109.059 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.31 -176.98 1.99 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.937 0.495 . . . . 0.0 110.995 173.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.41 -15.06 51.39 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 115.434 0.934 . . . . 0.0 115.434 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -79.77 -14.22 58.87 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.473 0.709 . . . . 0.0 111.723 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.09 6.87 78.25 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 -165.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -84.12 117.43 23.46 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 124.465 1.106 . . . . 0.0 109.961 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.7 m -64.93 119.73 11.26 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 171.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.1 pt -104.91 -24.93 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.292 1.037 . . . . 0.0 109.993 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 13.0 tp -145.61 134.26 22.19 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -170.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.53 HG23 HG12 ' A' ' 34' ' ' VAL . 59.7 m -132.74 123.64 26.63 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.759 0.823 . . . . 0.0 108.951 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 t -83.52 -179.29 7.31 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.292 0.637 . . . . 0.0 111.408 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 93' ' ' ILE . 27.1 mm-40 -68.75 170.32 9.68 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.588 0.755 . . . . 0.0 111.643 174.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.8 mm? -89.65 113.67 25.18 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 171.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -99.1 152.15 20.17 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 124.42 1.088 . . . . 0.0 109.859 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 65.5 p -82.84 -17.58 43.44 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.515 0.726 . . . . 0.0 110.932 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.0 m -138.23 149.51 45.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.114 0.966 . . . . 0.0 110.076 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.61 ' HB2' HD21 ' A' ' 23' ' ' LEU . 3.1 pptp? -71.88 -27.17 62.67 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.194 0.598 . . . . 0.0 110.444 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 14.8 t -68.77 -27.86 66.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.989 0.516 . . . . 0.0 111.046 174.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 14.6 m -69.31 -36.42 76.99 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.034 0.534 . . . . 0.0 109.637 174.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.88 -30.94 67.45 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.167 174.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -64.39 -43.64 93.83 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.883 0.873 . . . . 0.0 110.479 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 53' ' ' THR . 2.8 mmmp? -64.9 -34.05 77.49 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.981 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.63 -49.55 68.3 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.352 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.9 tt -71.4 -32.24 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 122.607 0.363 . . . . 0.0 111.076 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.95 -38.69 86.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.158 0.504 . . . . 0.0 109.796 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.6 m -71.48 -43.22 66.97 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.796 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 m -62.36 -32.65 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 118.897 0.771 . . . . 0.0 110.608 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.484 HH22 ' N ' ' A' ' 120' ' ' GLN . 14.9 ttm180 -70.39 -40.11 74.15 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.677 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -68.63 -22.28 64.43 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.101 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.48 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 60.7 m-80 -98.54 -1.94 39.91 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.441 0.696 . . . . 0.0 112.156 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.1 m -63.15 -45.76 85.85 Favored Pre-proline 0 CA--C 1.568 1.663 0 CA-C-O 118.275 -0.869 . . . . 0.0 111.657 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.8 -37.88 8.47 Favored 'Trans proline' 0 C--N 1.398 3.158 0 C-N-CA 121.762 1.641 . . . . 0.0 111.812 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' A' ' 65' ' ' ASN . 9.5 pt20 -98.66 58.28 1.2 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.934 1.35 . . . . 0.0 109.408 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.27 -11.71 34.29 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 113.27 -1.786 . . . . 0.0 112.899 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.19 -25.01 65.03 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.868 0.867 . . . . 0.0 111.894 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.69 -15.6 61.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.011 0.524 . . . . 0.0 112.367 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.82 127.39 31.36 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -96.92 107.33 19.82 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.506 0.722 . . . . 0.0 111.532 -168.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -73.51 112.0 9.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.034 0.534 . . . . 0.0 109.76 174.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.411 ' HE2' ' OD1' ' A' ' 85' ' ' ASN . 55.1 mtmt -134.36 143.5 47.69 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 171.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.3 m -101.49 133.36 46.26 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.55 0.74 . . . . 0.0 109.71 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.4 11.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.121 0.968 . . . . 0.0 111.649 176.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 p -64.47 -25.97 68.23 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.892 0.877 . . . . 0.0 111.473 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -70.02 -23.75 63.17 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.643 0.777 . . . . 0.0 111.332 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.62 30.91 5.97 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.317 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -113.55 125.9 54.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.409 0.683 . . . . 0.0 110.921 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -83.1 128.6 34.63 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.058 0.943 . . . . 0.0 110.391 -170.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -138.37 173.58 11.46 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -131.09 135.53 47.59 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.411 ' OD1' ' HE2' ' A' ' 75' ' ' LYS . 5.2 p-10 -115.51 129.51 56.56 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -91.69 99.38 12.29 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 173.362 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -106.55 135.97 47.13 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.216 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.472 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -100.85 170.71 8.13 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.33 1.052 . . . . 0.0 111.052 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.11 -8.95 13.72 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.509 0.723 . . . . 0.0 112.936 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.65 7.87 18.86 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.082 0.953 . . . . 0.0 111.311 175.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 87' ' ' LYS . 30.7 m170 63.97 21.94 12.79 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.971 1.309 . . . . 0.0 111.687 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -116.82 129.85 56.34 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.831 0.853 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 96' ' ' SER . 40.0 mt -74.05 100.73 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 122.076 0.941 . . . . 0.0 109.519 173.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 86' ' ' LEU . 16.2 pt -75.66 -6.57 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.279 -176.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.01 99.14 0.13 Allowed Glycine 0 C--N 1.353 1.491 0 CA-C-O 120.082 -0.288 . . . . 0.0 112.528 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 93' ' ' ILE . 34.3 p -92.45 116.77 29.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.4 t -69.39 164.5 22.84 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 122.975 0.51 . . . . 0.0 111.248 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -73.0 156.12 39.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.54 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 67.7 mtm -72.9 116.97 14.05 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -90.63 143.5 26.68 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 124.003 0.921 . . . . 0.0 109.17 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.04 -39.38 79.23 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.021 0.528 . . . . 0.0 110.675 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 65.3 p -117.16 150.24 39.03 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.696 0.798 . . . . 0.0 110.949 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -69.78 -25.77 63.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.052 0.941 . . . . 0.0 111.909 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.86 -29.98 68.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.686 0.394 . . . . 0.0 111.535 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -71.27 -23.99 62.07 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.123 0.569 . . . . 0.0 111.318 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.436 ' O ' HG12 ' A' ' 110' ' ' ILE . 13.1 ttt180 -61.34 -49.55 76.53 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.203 0.601 . . . . 0.0 109.754 169.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.31 -38.11 88.14 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.155 0.982 . . . . 0.0 111.223 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 48.4 m -66.32 -37.28 85.02 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.178 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.33 -35.84 88.37 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.903 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 106' ' ' ARG . 43.6 mm -59.83 -46.67 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.02 -35.66 81.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.831 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.6 t -71.1 -42.93 68.65 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.708 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.92 -27.08 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.506 0.723 . . . . 0.0 111.058 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -66.04 -47.42 74.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.011 0.925 . . . . 0.0 108.997 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.39 -47.69 22.39 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.647 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.461 ' HB3' HD11 ' A' ' 35' ' ' LEU . 77.9 m-20 -83.66 -14.37 51.98 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.51 0.724 . . . . 0.0 111.952 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -70.62 -30.57 68.53 Favored Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.104 -0.399 . . . . 0.0 112.104 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -91.17 9.18 32.18 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.025 0.93 . . . . 0.0 111.343 175.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -103.51 108.68 20.04 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.182 0.993 . . . . 0.0 108.852 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.484 ' N ' HH22 ' A' ' 63' ' ' ARG . 48.5 tt0 -92.82 38.66 1.03 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.276 0.63 . . . . 0.0 111.108 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.3 m -79.26 75.72 5.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 t -91.04 97.5 7.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -77.54 125.55 29.52 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.652 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -77.47 95.17 4.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 172.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.32 -0.75 57.23 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 121.595 0.712 . . . . 0.0 109.44 174.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.424 HG22 ' HB3' ' A' ' 25' ' ' LYS . 25.9 p -72.53 116.81 13.44 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 169.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 87.9 25.68 31.37 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-N 116.606 -0.27 . . . . 0.0 113.023 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.1 m -78.49 82.24 4.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.606 0.762 . . . . 0.0 109.186 174.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 CA--C 1.558 1.274 0 C-N-CA 123.118 0.567 . . . . 0.0 111.139 -177.107 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.337 0 N-CA-C 112.002 -0.439 . . . . 0.0 112.002 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -81.25 157.26 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.443 0.697 . . . . 0.0 110.429 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.6 pt -81.58 161.04 3.78 Favored 'Isoleucine or valine' 0 C--O 1.248 1.017 0 C-N-CA 123.182 0.593 . . . . 0.0 110.334 175.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -73.3 110.12 7.35 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 173.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.426 ' HB1' ' HA3' ' A' ' 38' ' ' GLY . . . -71.17 83.59 0.73 Allowed 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.175 0.59 . . . . 0.0 110.047 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 174.03 149.22 6.91 Favored Glycine 0 C--N 1.34 0.754 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.802 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -145.16 150.06 36.08 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.413 1.085 . . . . 0.0 110.186 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -95.34 153.03 17.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.843 0.857 . . . . 0.0 109.46 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -133.32 109.77 9.6 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.5 tp -82.01 102.0 10.69 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -101.11 -177.63 3.51 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.432 1.093 . . . . 0.0 109.507 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 18.7 ptpt -138.71 165.9 25.77 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.041 0.536 . . . . 0.0 109.757 169.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.3 t -100.55 -174.07 2.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.861 0.864 . . . . 0.0 108.878 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 t -62.28 -35.28 78.53 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.458 0.703 . . . . 0.0 111.525 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -90.79 26.37 2.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.154 0.582 . . . . 0.0 111.532 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.508 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.2 m-20 62.99 19.22 11.5 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.536 1.134 . . . . 0.0 112.263 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -71.52 116.5 11.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.671 0.788 . . . . 0.0 109.731 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.5 120.61 28.02 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.001 0.521 . . . . 0.0 110.06 -168.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 ttt85 -142.51 116.25 9.23 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.028 1.331 . . . . 0.0 108.116 -170.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -102.91 145.83 29.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.241 0.544 . . . . 0.0 110.597 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.573 HG12 HG23 ' A' ' 45' ' ' THR . 29.5 m -106.86 171.4 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 108.789 175.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 24.3 tp -137.54 109.56 7.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 173.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 65.5 mttm -95.14 141.93 28.18 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 178.05 7.01 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 168.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' HA3' ' HB1' ' A' ' 18' ' ' ALA . . . -64.52 -18.22 63.21 Favored Glycine 0 N--CA 1.48 1.596 0 C-N-CA 122.898 0.285 . . . . 0.0 113.035 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -63.73 -21.57 66.47 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 125.156 1.382 . . . . 0.0 111.89 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.82 2.22 75.66 Favored Glycine 0 C--N 1.35 1.354 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -173.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -98.35 130.43 45.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.918 1.287 . . . . 0.0 109.818 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 30.4 m -72.34 121.47 19.53 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.391 0.615 . . . . 0.0 110.532 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -99.99 -24.37 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.92 1.288 . . . . 0.0 111.5 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -146.1 143.62 29.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.573 HG23 HG12 ' A' ' 34' ' ' VAL . 48.2 m -146.15 114.48 6.68 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.308 0.643 . . . . 0.0 109.71 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 m -69.39 164.29 23.3 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.931 0.892 . . . . 0.0 111.347 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -83.39 178.19 8.15 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.394 0.616 . . . . 0.0 111.948 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.57 113.36 11.74 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.222 -177.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.76 156.78 16.18 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.006 0.922 . . . . 0.0 109.002 171.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.7 m -82.31 -24.47 34.61 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 173.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.7 t -126.61 146.87 50.0 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.365 0.666 . . . . 0.0 111.316 -174.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.5 ' HD3' ' H ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -75.08 -27.84 60.09 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.207 176.389 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.7 m -63.49 -38.42 91.07 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.54 1.536 . . . . 0.0 110.925 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.3 m -65.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.551 0.74 . . . . 0.0 110.606 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.31 -30.81 57.87 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.158 0.983 . . . . 0.0 111.92 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -73.98 -38.08 64.26 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.516 0.726 . . . . 0.0 110.143 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -22.79 52.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.248 169.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.97 93.36 Favored Glycine 0 C--N 1.349 1.281 0 O-C-N 123.745 0.653 . . . . 0.0 112.655 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.494 ' HA ' HG22 ' A' ' 62' ' ' VAL . 5.7 tt -65.55 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 122.341 0.256 . . . . 0.0 110.37 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -35.76 81.56 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.074 0.55 . . . . 0.0 110.893 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.9 m -73.7 -43.84 58.17 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.57 0.748 . . . . 0.0 111.621 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.494 HG22 ' HA ' ' A' ' 59' ' ' ILE . 18.8 m -70.11 -29.11 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -67.89 -45.14 75.33 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.919 0.888 . . . . 0.0 108.887 176.89 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 42.6 t -64.97 -15.79 62.63 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.076 0.95 . . . . 0.0 111.892 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.99 18.47 9.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.443 0.697 . . . . 0.0 112.392 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -63.19 -45.85 85.67 Favored Pre-proline 0 CA--C 1.567 1.619 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.195 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.64 -12.81 11.03 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 121.614 1.543 . . . . 0.0 113.093 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -75.98 84.66 2.88 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.484 0.659 . . . . 0.0 110.868 -173.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.06 -28.7 70.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.147 1.379 . . . . 0.0 112.045 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -63.24 -35.82 81.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.659 0.783 . . . . 0.0 110.824 174.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' HA ' ' NE ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.19 -19.99 35.48 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.453 -174.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -70.83 106.3 3.55 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 167.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -97.63 107.4 19.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.494 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.99 123.69 43.45 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.118 0.967 . . . . 0.0 109.75 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -132.99 150.65 52.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.844 1.257 . . . . 0.0 109.633 -175.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.2 m -92.79 117.26 29.82 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.581 0.752 . . . . 0.0 109.518 171.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.86 163.53 7.46 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.078 0.951 . . . . 0.0 112.235 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -68.58 -14.68 63.18 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.269 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -82.79 1.87 36.85 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.086 0.955 . . . . 0.0 111.772 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.81 32.91 58.52 Favored Glycine 0 C--N 1.353 1.506 0 C-N-CA 123.121 0.391 . . . . 0.0 112.951 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 74.8 mmtt -122.94 150.28 43.16 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.114 0.965 . . . . 0.0 109.728 -177.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -96.57 126.82 42.02 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.307 0.643 . . . . 0.0 109.987 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -137.79 176.69 8.48 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -141.46 166.14 25.56 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.907 0.483 . . . . 0.0 110.116 173.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.421 ' N ' HD22 ' A' ' 85' ' ' ASN . 0.0 OUTLIER -148.51 135.57 20.12 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.694 HD12 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -88.51 119.41 28.93 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -93.16 139.28 30.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.318 1.047 . . . . 0.0 109.896 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.2 176.1 7.09 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.279 0.632 . . . . 0.0 110.643 177.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.63 -23.71 65.38 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 121.448 0.642 . . . . 0.0 110.126 169.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -79.56 -3.81 48.6 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.728 174.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.6 m80 65.42 15.57 10.09 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 125.737 1.615 . . . . 0.0 111.235 -175.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -88.23 154.7 20.22 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 123.703 0.801 . . . . 0.0 110.048 177.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.476 HG21 ' HB2' ' A' ' 96' ' ' SER . 13.9 mm -84.14 99.16 6.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.694 HD11 HD12 ' A' ' 86' ' ' LEU . 10.0 pt -83.6 -8.38 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 122.801 0.44 . . . . 0.0 111.82 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.76 103.85 0.19 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.802 -0.443 . . . . 0.0 112.293 176.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.476 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.6 t -100.57 119.39 38.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.805 0.842 . . . . 0.0 109.229 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.3 t -73.77 167.33 21.63 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.94 0.496 . . . . 0.0 110.8 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -85.38 166.63 16.26 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.382 0.673 . . . . 0.0 110.494 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 72.1 mtm -74.35 118.63 17.54 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.579 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -94.41 144.3 25.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.124 0.97 . . . . 0.0 109.005 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.536 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -62.25 -58.02 9.28 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.418 0.687 . . . . 0.0 110.707 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.7 p -110.73 169.15 8.95 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.022 0.929 . . . . 0.0 110.954 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.74 -30.01 65.15 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.97 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -64.41 -32.49 74.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.109 0.564 . . . . 0.0 110.971 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.4 t -79.05 -32.89 45.02 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.755 0.822 . . . . 0.0 110.426 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -69.22 -38.72 78.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.724 0.81 . . . . 0.0 111.515 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -75.61 -29.87 59.38 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 122.95 0.5 . . . . 0.0 111.281 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 47.0 m -65.83 -34.31 77.86 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.43 -46.22 93.11 Favored Glycine 0 C--N 1.351 1.372 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.153 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.0 mm -55.09 -46.84 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.54 0.736 . . . . 0.0 109.839 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.22 93.16 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.9 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.7 t -71.63 -46.57 58.66 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.205 0.602 . . . . 0.0 110.361 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 81.0 t -64.86 -30.9 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.943 0.897 . . . . 0.0 111.124 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.92 -51.5 54.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.362 0.665 . . . . 0.0 110.405 173.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.84 -20.94 55.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.802 0.841 . . . . 0.0 112.431 -172.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -112.17 -8.16 14.01 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.824 0.849 . . . . 0.0 111.051 -178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.74 -28.13 65.72 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 172.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 12.6 t -74.25 -9.36 58.53 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.0 0.92 . . . . 0.0 111.83 175.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.4 t -72.92 147.01 45.71 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.206 0.602 . . . . 0.0 109.437 176.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -131.46 25.21 4.8 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.589 0.756 . . . . 0.0 110.657 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.4 t -95.88 110.84 22.96 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 172.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.3 t -119.27 117.32 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 110.209 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -78.27 135.74 37.61 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.124 . . . . 0.0 109.182 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -89.02 107.99 19.34 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -114.76 15.39 17.52 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.657 0.783 . . . . 0.0 110.305 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.6 p -64.15 89.05 0.06 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.431 0.692 . . . . 0.0 111.745 -175.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLY . . . . . 0.423 ' N ' ' HG2' ' A' ' 25' ' ' LYS . . . 66.27 44.37 90.93 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.816 175.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 17.8 t -68.8 90.81 0.43 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.683 0.793 . . . . 0.0 109.744 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.2 t30 . . . . . 0 C--O 1.251 1.145 0 C-N-CA 124.216 1.006 . . . . 0.0 109.585 -172.0 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m -89.14 152.55 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.511 0.725 . . . . 0.0 110.11 174.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 pp -83.14 161.87 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 122.763 0.425 . . . . 0.0 110.463 174.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.5 mmt -128.61 130.63 47.58 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.33 74.89 9.27 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.268 0.627 . . . . 0.0 110.602 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.6 157.04 7.49 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.391 -0.822 . . . . 0.0 113.751 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -165.39 155.52 13.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.296 1.038 . . . . 0.0 109.842 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' HD13 ' A' ' 35' ' ' LEU . 59.6 m-85 -97.4 148.41 23.21 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.575 0.75 . . . . 0.0 109.937 169.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -129.75 117.61 20.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.852 0.861 . . . . 0.0 108.703 170.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 31' ' ' PHE . 28.7 tp -81.63 102.45 10.68 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 175.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.1 m -106.49 162.84 13.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.217 1.007 . . . . 0.0 108.816 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -121.44 165.68 15.23 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 61.0 p -96.75 173.79 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 123.932 0.893 . . . . 0.0 110.034 176.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.1 t -67.46 -21.72 65.53 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.351 0.596 . . . . 0.0 110.244 171.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.78 -13.14 60.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.321 1.048 . . . . 0.0 111.657 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 86.0 -7.04 0.8 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 126.348 1.859 . . . . 0.0 112.4 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.642 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 8.7 mp0 -65.63 132.96 50.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.196 0.598 . . . . 0.0 110.675 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.521 ' HB3' HD11 ' A' ' 23' ' ' LEU . 83.7 m-85 -91.31 148.54 22.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.358 1.063 . . . . 0.0 110.58 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -152.59 129.9 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.433 0.693 . . . . 0.0 109.306 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -91.21 126.93 36.45 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 173.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.38 130.27 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -99.25 123.01 43.2 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 173.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -118.68 149.51 41.29 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.259 1.024 . . . . 0.0 108.901 177.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.84 -179.15 6.4 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.441 0.696 . . . . 0.0 110.242 172.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.44 -20.27 65.41 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-O 120.997 0.221 . . . . 0.0 112.99 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -78.43 -10.3 59.64 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.293 1.037 . . . . 0.0 111.186 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.81 -0.66 89.15 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 123.035 0.35 . . . . 0.0 113.067 -175.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.38 121.76 20.06 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.064 0.945 . . . . 0.0 110.132 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 m -71.39 120.2 16.63 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 35' ' ' LEU . 26.7 pt -109.98 -8.35 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.699 1.2 . . . . 0.0 111.159 -177.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 16.9 tp -164.31 151.25 11.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.153 0.581 . . . . 0.0 110.487 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 46.7 m -146.1 126.34 13.89 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.462 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 87.3 p -67.01 155.13 39.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.35 0.66 . . . . 0.0 111.031 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.86 138.39 58.14 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 10.4 mp -64.07 111.97 2.77 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.199 0.523 . . . . 0.0 110.582 -173.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.3 m-85 -82.34 147.6 28.76 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.247 1.019 . . . . 0.0 110.657 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 m -69.76 -37.24 76.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.562 0.745 . . . . 0.0 110.886 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -112.69 155.33 24.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.564 0.746 . . . . 0.0 110.848 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -62.91 -43.18 99.48 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.946 0.898 . . . . 0.0 109.14 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.5 p -61.02 -40.78 94.85 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.086 0.866 . . . . 0.0 110.917 -177.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 20.0 m -63.13 -39.97 96.23 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.613 0.765 . . . . 0.0 110.931 178.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.2 84.32 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.527 0.731 . . . . 0.0 110.992 176.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -68.66 -32.11 71.71 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.667 0.787 . . . . 0.0 111.082 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -77.82 -22.94 49.25 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.086 0.554 . . . . 0.0 110.949 171.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.57 94.83 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.819 0.699 . . . . 0.0 113.778 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.5 tt -64.16 -37.79 80.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 117.02 0.41 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.96 71.27 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.289 0.635 . . . . 0.0 110.952 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 m -73.14 -49.96 25.32 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.624 177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 59' ' ' ILE . 26.0 m -65.46 -38.8 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.538 -173.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -65.56 -32.99 74.88 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.074 0.464 . . . . 0.0 110.923 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 t -74.27 -24.53 59.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.594 0.758 . . . . 0.0 111.03 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -107.41 3.1 24.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.312 0.645 . . . . 0.0 111.469 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 75.7 m -63.76 -43.6 77.22 Favored Pre-proline 0 N--CA 1.487 1.393 0 CA-C-O 118.545 -0.741 . . . . 0.0 112.768 174.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -83.95 18.93 1.44 Allowed 'Trans proline' 0 C--N 1.38 2.222 0 CA-C-N 121.657 1.628 . . . . 0.0 113.02 175.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -118.79 96.63 5.34 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.09 0.956 . . . . 0.0 109.895 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -26.7 68.4 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.917 0.487 . . . . 0.0 110.199 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -45.88 -40.8 10.49 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.815 1.646 . . . . 0.0 112.513 171.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -90.06 -23.82 21.33 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.338 0.655 . . . . 0.0 111.253 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -70.41 118.41 13.19 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 120.649 0.262 . . . . 0.0 110.333 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -96.04 98.64 10.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -66.45 103.61 1.08 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -124.87 139.77 53.53 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.642 0.777 . . . . 0.0 109.731 -164.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -97.28 127.93 43.68 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.228 0.611 . . . . 0.0 110.083 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.28 150.67 40.1 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.887 0.875 . . . . 0.0 110.71 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 t -71.4 -8.17 52.08 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 121.313 0.578 . . . . 0.0 110.016 171.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -74.57 -3.74 32.84 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.557 1.143 . . . . 0.0 111.906 169.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.94 13.51 82.08 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 123.042 0.353 . . . . 0.0 112.625 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -110.64 178.42 4.37 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.208 1.003 . . . . 0.0 110.202 -177.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -126.3 127.77 46.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.69 0.396 . . . . 0.0 110.982 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.604 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 20.3 p90 -129.65 176.7 7.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.835 1.254 . . . . 0.0 108.688 174.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -133.54 150.35 51.67 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.768 0.318 . . . . 0.0 110.174 174.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -133.41 124.08 26.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.52 129.23 34.88 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 123.816 0.847 . . . . 0.0 109.614 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -99.82 162.01 13.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.298 1.039 . . . . 0.0 111.355 -178.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.43 179.52 4.25 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.183 -1.372 . . . . 0.0 109.413 173.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.36 -15.63 63.35 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.06 0.544 . . . . 0.0 111.128 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -96.9 16.49 19.2 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.661 0.784 . . . . 0.0 111.968 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 80.6 m80 64.24 9.5 4.86 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 124.433 1.093 . . . . 0.0 112.723 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -88.04 146.47 25.45 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.248 0.619 . . . . 0.0 110.508 -176.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.4 mt -82.88 100.57 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.9 pt -86.98 -13.1 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.829 177.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.462 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -153.11 149.83 21.47 Favored Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 176.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 p -158.32 128.54 6.07 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.479 0.711 . . . . 0.0 109.502 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.7 t -107.37 166.97 10.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.688 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -75.03 161.24 29.62 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.508 0.723 . . . . 0.0 110.724 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.604 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -74.7 118.67 17.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.381 0.61 . . . . 0.0 110.005 -178.804 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.51 148.44 27.21 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.316 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.33 71.79 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.956 0.902 . . . . 0.0 112.117 -177.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.3 p -128.94 162.68 27.0 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.483 0.713 . . . . 0.0 110.188 175.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -65.5 -36.09 82.81 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.139 172.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.0 -37.91 89.06 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.489 0.715 . . . . 0.0 111.503 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.0 t -67.92 -30.58 69.94 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.57 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -70.59 -38.21 74.0 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.865 0.466 . . . . 0.0 110.704 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 7.1 mm-40 -68.09 -28.9 67.74 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.127 0.571 . . . . 0.0 111.011 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.2 m -61.72 -45.95 91.75 Favored 'General case' 0 C--N 1.349 0.577 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.07 -34.84 91.01 Favored Glycine 0 C--N 1.349 1.285 0 CA-C-N 115.056 -0.974 . . . . 0.0 113.526 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 28.6 mm -60.05 -52.37 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.1 66.44 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.473 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.1 t -70.72 -50.07 40.2 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.248 0.619 . . . . 0.0 110.003 -178.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.55 -30.67 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 C-N-CA 123.504 0.721 . . . . 0.0 110.871 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 83.9 tttt -64.2 -35.02 79.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.432 0.693 . . . . 0.0 111.45 177.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -93.49 -36.17 12.58 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.663 0.785 . . . . 0.0 112.49 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -103.76 -8.56 19.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.096 0.958 . . . . 0.0 111.785 -168.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.61 -22.79 73.61 Favored Glycine 0 N--CA 1.472 1.041 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.131 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -84.06 -12.12 55.63 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.662 0.785 . . . . 0.0 111.354 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.8 m -69.42 101.59 1.59 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 109.888 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -82.86 18.95 1.45 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.272 0.629 . . . . 0.0 111.915 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.6 m -75.32 93.95 2.96 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.298 1.039 . . . . 0.0 109.353 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.62 139.32 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.662 0.785 . . . . 0.0 110.903 -172.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -118.91 115.36 24.21 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.351 1.06 . . . . 0.0 109.099 175.922 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.38 97.35 7.68 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 121.421 0.629 . . . . 0.0 111.142 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.59 -16.01 58.87 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.179 0.992 . . . . 0.0 111.312 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 35.9 p -61.58 114.88 3.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.553 1.141 . . . . 0.0 112.459 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 82.66 56.73 2.72 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.707 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.4 t -133.64 164.28 27.55 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.643 0.777 . . . . 0.0 109.753 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 N--CA 1.487 1.407 0 C-N-CA 123.517 0.727 . . . . 0.0 112.045 -174.675 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.196 0 CA-C-O 119.928 -0.373 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 36.0 m -89.95 159.61 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.028 0.931 . . . . 0.0 109.952 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.3 pt -72.06 149.16 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 120.885 0.374 . . . . 0.0 110.117 174.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.405 ' HB3' ' HA3' ' A' ' 38' ' ' GLY . 21.0 mmt -103.76 104.17 14.15 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.093 0.557 . . . . 0.0 109.589 -178.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.58 131.45 40.31 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.14 173.78 50.47 Favored Glycine 0 C--N 1.333 0.415 0 O-C-N 123.375 0.422 . . . . 0.0 113.526 -179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 38.3 p90 -119.51 160.3 22.66 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.916 0.887 . . . . 0.0 110.597 -173.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -86.95 153.31 21.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.976 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.438 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 86.6 mt-10 -132.86 121.21 22.57 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 167.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.28 98.16 5.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -99.33 163.04 12.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.84 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 17.2 ptpt -133.83 134.12 42.42 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 168.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.9 m -76.62 175.47 9.27 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.319 0.581 . . . . 0.0 110.896 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 t -67.5 -12.58 60.65 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.619 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -83.37 3.59 31.08 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.658 1.183 . . . . 0.0 112.219 175.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 m120 65.67 15.32 9.99 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.167 0.987 . . . . 0.0 111.923 -175.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HB2' HD12 ' A' ' 48' ' ' LEU . 15.0 mm100 -96.29 137.76 34.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.864 0.865 . . . . 0.0 109.914 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -90.55 144.22 25.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.034 0.534 . . . . 0.0 110.73 -175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -156.97 147.04 20.96 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 109.064 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -94.28 127.5 40.18 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.3 m -107.47 132.8 54.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.684 HD22 ' HB3' ' A' ' 116' ' ' ASN . 11.5 mt -99.24 112.24 24.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.395 0.678 . . . . 0.0 109.257 177.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -102.75 125.94 49.68 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.98 178.05 1.2 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 123.758 0.661 . . . . 0.0 111.097 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.405 ' HA3' ' HB3' ' A' ' 17' ' ' MET . . . -61.91 -12.75 37.34 Favored Glycine 0 CA--C 1.541 1.685 0 N-CA-C 114.079 0.392 . . . . 0.0 114.079 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -85.2 -6.22 59.29 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.411 1.085 . . . . 0.0 112.017 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 14.32 81.9 Favored Glycine 0 N--CA 1.473 1.121 0 C-N-CA 122.727 0.204 . . . . 0.0 112.982 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -102.75 121.5 42.59 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.328 1.051 . . . . 0.0 109.764 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.1 m -66.21 120.97 14.17 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.074 0.55 . . . . 0.0 110.459 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.2 pt -99.93 -35.41 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 124.616 1.166 . . . . 0.0 110.366 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 20.4 tp -137.38 148.47 46.25 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.701 0.801 . . . . 0.0 109.926 -169.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.1 m -145.15 116.81 8.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.32 0.648 . . . . 0.0 109.506 175.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.5 t -65.44 157.72 28.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.087 0.955 . . . . 0.0 110.801 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.84 164.83 18.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.126 0.571 . . . . 0.0 111.153 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.5 mm? -70.65 127.92 34.33 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.167 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.452 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -107.7 142.68 37.32 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.119 0.968 . . . . 0.0 109.706 177.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.3 -22.5 63.79 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.368 0.667 . . . . 0.0 111.749 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.7 t -148.42 159.5 43.97 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.237 0.615 . . . . 0.0 111.483 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -27.96 68.3 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.786 0.835 . . . . 0.0 111.177 176.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.9 t -71.27 -32.51 68.79 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.912 0.485 . . . . 0.0 110.731 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.452 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 16.4 m -69.04 -40.87 78.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.492 0.717 . . . . 0.0 109.61 173.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.98 -31.67 72.39 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.355 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.83 -40.33 95.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.546 0.739 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -71.3 -34.37 70.55 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.525 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.45 98.29 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.637 -0.711 . . . . 0.0 113.14 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.6 tt -74.68 -37.73 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.741 0.27 . . . . 0.0 110.742 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.62 70.47 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.059 0.544 . . . . 0.0 110.267 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 m -71.53 -55.71 7.29 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.708 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 59' ' ' ILE . 33.7 m -59.61 -31.2 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-N 118.27 0.486 . . . . 0.0 111.758 -176.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -62.5 -47.85 82.12 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.54 1.136 . . . . 0.0 110.546 176.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.3 m -72.26 -26.1 61.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.025 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.496 ' ND2' ' HG2' ' A' ' 71' ' ' ARG . 4.3 m-20 -96.39 1.59 51.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.326 1.051 . . . . 0.0 111.794 -174.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.548 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 23.5 m -59.46 -50.27 88.08 Favored Pre-proline 0 CA--C 1.565 1.525 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.777 175.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -83.03 -5.78 11.29 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.824 1.682 . . . . 0.0 113.232 175.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -83.32 78.35 9.64 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.62 -30.22 71.36 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.925 0.89 . . . . 0.0 112.055 -175.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.18 -24.45 59.37 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.626 0.77 . . . . 0.0 111.195 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.496 ' HG2' ' ND2' ' A' ' 65' ' ' ASN . 3.4 tpm_? -75.79 -23.25 55.87 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.196 0.599 . . . . 0.0 110.661 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -70.55 120.56 16.36 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -101.36 108.3 19.88 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.482 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 135.58 33.49 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.665 0.386 . . . . 0.0 110.093 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -155.59 161.43 40.84 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 109.747 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.9 m -92.56 141.55 28.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.05 0.54 . . . . 0.0 109.814 176.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.69 158.0 28.45 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.712 0.805 . . . . 0.0 109.943 170.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.9 t -64.06 -23.79 67.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.307 0.643 . . . . 0.0 110.714 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -66.9 -18.44 65.38 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.876 0.871 . . . . 0.0 111.693 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.88 -7.9 42.12 Favored Glycine 0 C--N 1.349 1.271 0 C-N-CA 122.961 0.315 . . . . 0.0 113.591 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.529 ' HG3' ' HA ' ' A' ' 101' ' ' ALA . 0.0 OUTLIER -99.31 146.18 26.52 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.18 0.592 . . . . 0.0 110.734 -176.367 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -90.43 139.19 30.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.155 0.982 . . . . 0.0 110.415 -172.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -148.64 174.86 11.71 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.674 0.79 . . . . 0.0 109.268 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -131.14 138.74 49.6 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.458 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.547 HD22 HD13 ' A' ' 93' ' ' ILE . 11.5 m-20 -114.9 105.56 13.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.892 1.277 . . . . 0.0 108.904 172.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.7 OUTLIER -78.7 111.6 14.96 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 173.216 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -120.73 146.18 46.74 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 176.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.415 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -86.44 -173.88 4.74 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.443 0.697 . . . . 0.0 111.13 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.35 -28.1 67.91 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -95.9 24.42 5.49 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.096 0.558 . . . . 0.0 111.571 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.0 t60 72.3 -3.79 2.19 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -70.61 112.63 7.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.381 0.672 . . . . 0.0 109.93 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.547 HD13 HD22 ' A' ' 85' ' ' ASN . 57.0 mt -67.39 98.35 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 122.032 0.92 . . . . 0.0 109.071 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 21.3 pt -82.67 -6.68 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.144 -178.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -164.03 117.24 0.75 Allowed Glycine 0 C--N 1.345 1.034 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.5 t -116.12 114.86 25.07 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.903 0.881 . . . . 0.0 108.944 175.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.9 p -81.79 167.76 18.72 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.842 0.457 . . . . 0.0 111.283 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -77.23 164.31 25.72 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.226 177.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.8 ptp -73.58 123.5 24.1 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -102.31 122.08 43.54 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.77 0.828 . . . . 0.0 109.773 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.529 ' HA ' ' HG3' ' A' ' 81' ' ' LYS . . . -62.79 -40.72 98.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.816 0.846 . . . . 0.0 110.845 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.462 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 39.1 p -104.87 131.3 52.53 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.21 65.35 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.306 1.042 . . . . 0.0 111.828 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.462 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 10.8 pt20 -62.93 -37.43 87.0 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.024 0.53 . . . . 0.0 110.737 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 13.9 t -71.31 -28.53 64.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.383 0.673 . . . . 0.0 110.515 -177.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -67.36 -51.2 55.1 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.105 0.962 . . . . 0.0 109.87 177.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.96 -29.09 60.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.095 0.558 . . . . 0.0 111.948 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 98.0 m -67.57 -33.51 75.17 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.2 -30.12 76.56 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.171 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.3 mm -64.96 -49.39 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-O 121.368 0.604 . . . . 0.0 109.886 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.91 73.08 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.198 178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.2 t -71.13 -48.65 50.89 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.16 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.19 -27.12 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.448 0.699 . . . . 0.0 110.724 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 38.8 ttpt -66.59 -46.75 74.92 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 172.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.58 -33.66 69.24 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.906 0.883 . . . . 0.0 111.92 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.684 ' HB3' HD22 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -84.39 -30.99 24.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 0.0 110.01 -177.158 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.54 -41.17 58.27 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.5 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.1 p -80.47 -4.71 54.84 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.446 0.698 . . . . 0.0 111.713 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.8 t -75.77 -34.33 60.24 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.992 0.517 . . . . 0.0 109.835 173.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 67.75 -7.64 0.58 Allowed 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 125.37 1.468 . . . . 0.0 114.261 167.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 t -80.31 123.98 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.229 0.612 . . . . 0.0 110.768 -170.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 57.6 t -105.52 133.95 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 123.35 0.66 . . . . 0.0 111.303 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.438 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 43.1 tptt -110.45 141.76 43.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.11 1.364 . . . . 0.0 108.411 173.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -84.24 112.4 20.25 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -110.7 11.59 22.67 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.891 0.853 . . . . 0.0 109.687 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.455 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 21.7 p -70.51 156.75 38.97 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.255 1.022 . . . . 0.0 110.82 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 102.59 -42.18 1.96 Allowed Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -172.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 39.3 t -70.79 104.33 2.86 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.653 0.781 . . . . 0.0 109.097 173.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 123.797 0.839 . . . . 0.0 109.918 -176.772 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.907 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.5 m -85.04 155.86 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.362 0.665 . . . . 0.0 110.072 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.8 pt -74.3 156.15 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-O 121.013 0.435 . . . . 0.0 110.98 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.8 ptp -132.31 -179.66 5.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.141 0.976 . . . . 0.0 108.843 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.52 118.88 30.41 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 122.997 0.519 . . . . 0.0 110.447 -178.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . 88.8 143.05 9.04 Favored Glycine 0 C--N 1.348 1.229 0 O-C-N 123.499 0.5 . . . . 0.0 114.011 172.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -152.2 169.87 21.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.844 0.858 . . . . 0.0 109.958 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -109.98 127.15 54.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.347 1.059 . . . . 0.0 109.568 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -91.97 106.87 18.8 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 167.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 64.6 tp -85.52 98.5 10.66 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 176.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -113.37 177.92 4.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.937 0.895 . . . . 0.0 109.735 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -141.75 156.0 45.61 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.626 0.77 . . . . 0.0 109.935 175.658 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.6 m -89.86 178.69 6.17 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.126 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -66.65 -22.85 66.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.616 0.766 . . . . 0.0 110.801 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -91.11 15.36 11.86 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.415 0.686 . . . . 0.0 111.285 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 67.3 14.96 9.87 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.243 1.417 . . . . 0.0 112.75 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 16.0 mm100 -70.32 124.86 25.2 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.67 0.788 . . . . 0.0 110.997 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.84 118.68 24.64 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.809 0.844 . . . . 0.0 108.942 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -142.49 118.99 10.95 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.92 0.888 . . . . 0.0 109.093 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -94.04 132.03 38.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.603 HG12 HG23 ' A' ' 45' ' ' THR . 23.2 m -107.45 133.97 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 171.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.9 tp -90.0 120.79 31.51 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -106.8 153.95 21.72 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.692 1.197 . . . . 0.0 109.653 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.19 177.66 8.88 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.775 168.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.34 -23.53 62.43 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.449 173.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -67.35 -18.89 65.33 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.766 1.227 . . . . 0.0 111.769 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.89 -7.82 80.66 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.796 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.05 136.23 36.53 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.286 0.634 . . . . 0.0 109.712 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.0 m -73.15 120.84 19.33 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.342 0.591 . . . . 0.0 109.779 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.534 HD11 ' HG ' ' A' ' 35' ' ' LEU . 22.0 pt -103.74 -16.52 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.606 1.162 . . . . 0.0 111.245 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.7 tp -157.8 141.7 15.79 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.603 HG23 HG12 ' A' ' 34' ' ' VAL . 53.3 m -133.16 113.45 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.242 0.617 . . . . 0.0 109.652 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -69.5 164.82 22.3 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.964 0.506 . . . . 0.0 110.799 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -75.92 166.01 24.14 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.399 0.619 . . . . 0.0 111.601 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.86 114.18 15.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.642 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -100.37 145.57 28.02 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.587 0.755 . . . . 0.0 109.17 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -90.15 -2.13 58.03 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 120.988 0.423 . . . . 0.0 111.099 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.439 ' HB3' HG22 ' A' ' 53' ' ' THR . 50.8 m -142.03 137.25 30.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.507 0.723 . . . . 0.0 110.549 -177.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -28.24 69.78 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.939 0.895 . . . . 0.0 111.64 178.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.439 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -63.22 -33.72 76.11 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.459 0.704 . . . . 0.0 111.156 178.022 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 m -76.56 -31.65 57.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.632 0.773 . . . . 0.0 110.466 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.19 -32.39 66.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.507 0.723 . . . . 0.0 110.752 173.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -67.4 -49.11 65.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.959 0.904 . . . . 0.0 110.37 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.63 -36.57 84.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.617 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.6 -48.51 85.84 Favored Glycine 0 C--N 1.345 1.049 0 O-C-N 124.124 0.89 . . . . 0.0 112.563 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.544 ' HA ' HG22 ' A' ' 62' ' ' VAL . 15.9 tt -74.64 -31.48 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 116.608 0.204 . . . . 0.0 111.146 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.68 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.972 0.509 . . . . 0.0 110.331 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.0 m -73.37 -47.71 40.0 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.13 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -62.3 -35.29 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 118.654 0.661 . . . . 0.0 110.741 -177.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.713 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 12.2 ttp180 -66.25 -45.52 80.31 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.173 0.989 . . . . 0.0 110.357 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -67.92 -28.37 67.43 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.784 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.487 ' HB3' HD11 ' A' ' 86' ' ' LEU . 16.0 m120 -100.94 3.53 41.77 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.135 0.974 . . . . 0.0 111.777 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.0 m -63.11 -52.25 63.92 Favored Pre-proline 0 CA--C 1.56 1.346 0 CA-C-O 118.648 -0.691 . . . . 0.0 110.831 172.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.49 -19.46 42.82 Favored 'Trans proline' 0 C--N 1.4 3.238 0 C-N-CA 121.642 1.561 . . . . 0.0 111.65 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 -81.73 77.21 8.6 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 121.944 0.878 . . . . 0.0 109.542 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -66.95 -21.17 65.99 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.166 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -74.43 -31.69 62.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.717 0.807 . . . . 0.0 110.603 174.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -76.51 -25.5 54.25 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.324 0.65 . . . . 0.0 111.74 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.654 ' HE1' HG23 ' A' ' 110' ' ' ILE . 8.3 p90 -107.53 132.96 52.68 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 121.133 0.492 . . . . 0.0 110.407 172.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -97.31 117.11 30.79 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.064 -174.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB2' ' HD2' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -71.77 104.08 3.31 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.214 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -119.71 151.73 38.29 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.23 1.012 . . . . 0.0 110.6 -169.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.0 m -106.17 124.64 49.91 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.351 0.66 . . . . 0.0 109.755 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 166.24 16.83 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.487 1.115 . . . . 0.0 112.046 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.9 p -64.87 -16.9 63.78 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.06 0.944 . . . . 0.0 112.112 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -90.36 9.71 27.86 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.056 0.943 . . . . 0.0 110.999 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.44 6.85 71.62 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 123.026 0.345 . . . . 0.0 113.758 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 48.2 mmtm -88.98 152.26 21.81 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.069 0.948 . . . . 0.0 110.499 -177.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.43 ' HB3' ' HB2' ' A' ' 106' ' ' ARG . 89.4 m-85 -109.74 126.52 53.82 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.378 0.671 . . . . 0.0 111.017 -170.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.667 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 16.5 p90 -143.97 178.85 7.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.68 1.192 . . . . 0.0 108.538 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.504 ' HE2' HG21 ' A' ' 113' ' ' VAL . 19.6 p90 -146.26 135.08 22.38 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.6 p-10 -116.04 146.12 42.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.487 HD11 ' HB3' ' A' ' 65' ' ' ASN . 25.3 tp -119.08 120.35 36.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.667 0.787 . . . . 0.0 109.982 -173.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -91.89 149.96 21.29 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.487 1.115 . . . . 0.0 110.985 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -107.69 176.15 5.25 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.354 1.062 . . . . 0.0 109.554 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.55 -28.2 66.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.56 0.744 . . . . 0.0 111.632 175.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -81.41 5.88 16.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.6 m80 66.24 13.12 9.01 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.685 1.194 . . . . 0.0 111.916 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.77 153.42 17.77 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 124.042 0.937 . . . . 0.0 109.874 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.5 mm -81.85 119.02 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.2 pt -98.17 -8.98 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.187 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.92 111.36 0.33 Allowed Glycine 0 C--N 1.347 1.159 0 O-C-N 123.452 0.47 . . . . 0.0 112.344 175.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 p -114.91 131.6 56.82 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.1 t -85.97 158.19 19.94 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 123.175 0.59 . . . . 0.0 110.261 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -78.41 149.08 33.39 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.667 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.0 ptt? -74.06 117.32 15.72 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.23 0.538 . . . . 0.0 110.662 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -89.45 160.08 16.96 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.602 1.161 . . . . 0.0 111.283 -176.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.448 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -75.84 -52.44 10.36 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.063 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 67.9 p -85.37 142.77 29.06 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.467 -171.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.48 -25.77 64.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.949 0.9 . . . . 0.0 111.191 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -68.56 -36.36 78.66 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 122.98 0.512 . . . . 0.0 110.505 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.2 t -67.96 -23.2 65.02 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.858 0.863 . . . . 0.0 111.309 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.478 ' O ' HG12 ' A' ' 110' ' ' ILE . 55.7 ttp180 -61.28 -56.84 15.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.365 0.666 . . . . 0.0 109.547 172.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -72.94 -32.97 65.64 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.901 0.88 . . . . 0.0 111.753 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.9 m -67.28 -36.09 80.85 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.42 -35.84 63.15 Favored Glycine 0 C--N 1.347 1.187 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.04 176.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.654 HG23 ' HE1' ' A' ' 72' ' ' TYR . 45.4 mm -57.06 -46.9 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.4 0.68 . . . . 0.0 109.419 172.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.95 -37.06 78.62 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.232 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t -67.26 -51.92 47.1 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.059 -174.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.504 HG21 ' HE2' ' A' ' 84' ' ' PHE . 79.6 t -64.9 -31.98 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 123.24 0.616 . . . . 0.0 111.27 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.87 -39.38 94.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.502 0.721 . . . . 0.0 112.026 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -92.51 -43.82 8.96 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.313 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.473 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 10.7 m120 -83.98 -18.94 35.5 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.997 0.919 . . . . 0.0 111.746 -171.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.8 -27.75 64.25 Favored Glycine 0 C--N 1.341 0.808 0 O-C-N 123.168 0.292 . . . . 0.0 112.886 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 48.1 p -75.17 -7.83 54.9 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 87.7 p -68.98 -44.22 73.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.379 0.672 . . . . 0.0 111.308 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.471 ' HB2' ' HD3' ' A' ' 63' ' ' ARG . 43.6 tt0 61.9 13.78 5.82 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.028 1.331 . . . . 0.0 111.947 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 m -81.46 89.2 6.13 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.672 -0.643 . . . . 0.0 111.107 -169.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 10.4 m -85.48 112.3 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-O 121.601 0.715 . . . . 0.0 111.728 -176.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -83.03 102.78 11.99 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 164.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -72.04 95.31 1.59 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.464 1.126 . . . . 0.0 109.826 -177.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.7 6.31 44.55 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.604 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 p -60.31 89.83 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.592 1.157 . . . . 0.0 110.817 173.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.69 52.22 6.65 Favored Glycine 0 C--N 1.346 1.093 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.653 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.6 t -87.1 -173.76 4.58 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.123 0.569 . . . . 0.0 109.548 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 8.6 t30 . . . . . 0 C--O 1.257 1.467 0 C-N-CA 122.958 0.503 . . . . 0.0 109.777 173.536 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.4 m -64.75 124.54 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 123.75 0.82 . . . . 0.0 110.498 176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.7 pt -81.41 139.87 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 122.972 0.509 . . . . 0.0 110.956 -174.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 80.8 mtp -93.97 96.12 9.49 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.48 90.06 7.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.453 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.61 136.47 5.43 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.309 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -159.75 164.67 33.64 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.913 0.885 . . . . 0.0 110.272 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -104.47 154.41 19.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.024 0.93 . . . . 0.0 109.643 172.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.8 mt-10 -136.39 117.89 14.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.084 0.954 . . . . 0.0 109.238 169.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.567 HD21 ' HB2' ' A' ' 52' ' ' LYS . 64.2 tp -81.0 107.1 13.52 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 175.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.9 p -126.85 136.66 52.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.502 0.721 . . . . 0.0 110.946 -170.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -94.66 137.71 33.42 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.696 0.798 . . . . 0.0 108.855 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -93.91 -176.51 4.05 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.766 0.826 . . . . 0.0 111.432 -177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -67.6 -16.33 64.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.029 0.532 . . . . 0.0 110.559 174.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -68.85 -12.78 61.91 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.161 0.984 . . . . 0.0 112.072 174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 69.87 13.26 8.0 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.603 1.161 . . . . 0.0 110.493 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.541 ' HB2' HD12 ' A' ' 48' ' ' LEU . 14.7 mm-40 -108.22 150.62 27.03 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.111 0.964 . . . . 0.0 110.123 -176.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -100.88 128.92 46.71 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.027 0.931 . . . . 0.0 110.585 -169.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.0 ptt85 -143.79 139.63 29.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.617 0.767 . . . . 0.0 109.056 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -94.97 137.09 34.48 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.87 132.33 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 175.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -97.97 114.94 27.19 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -103.69 153.16 20.97 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.597 1.159 . . . . 0.0 110.375 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.8 -175.36 4.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.318 1.047 . . . . 0.0 110.234 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.56 -29.77 72.76 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 113.96 0.344 . . . . 0.0 113.96 -178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -72.58 -21.32 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.026 0.93 . . . . 0.0 111.086 176.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 7.5 59.5 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.204 -173.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -81.39 121.84 26.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.627 0.771 . . . . 0.0 109.748 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 m -70.08 121.64 17.86 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 122.914 0.485 . . . . 0.0 109.905 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.8 pt -100.06 -23.43 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.892 1.277 . . . . 0.0 110.74 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 18.8 tp -145.55 139.64 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.59 0.756 . . . . 0.0 109.574 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.3 m -135.91 125.2 24.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.508 0.723 . . . . 0.0 109.158 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -78.85 170.31 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.554 0.342 . . . . 0.0 110.99 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -74.38 161.64 29.65 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.522 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.8 mm? -68.75 111.6 4.96 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.038 174.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' A' ' 94' ' ' ILE . 79.3 m-85 -98.1 151.08 20.75 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.869 0.867 . . . . 0.0 109.992 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.35 -22.47 63.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.357 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.3 t -142.54 153.2 43.36 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.382 0.673 . . . . 0.0 110.705 -176.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HB2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -69.27 -27.22 65.23 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.654 175.451 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.7 p -60.81 -40.28 92.15 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.824 0.703 . . . . 0.0 110.659 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -65.43 -33.83 76.88 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.241 1.016 . . . . 0.0 111.347 177.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.24 -29.18 60.16 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.218 0.607 . . . . 0.0 111.402 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -74.32 -33.51 63.2 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.624 0.77 . . . . 0.0 110.24 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.5 -34.22 75.51 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.477 169.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -49.87 73.86 Favored Glycine 0 C--N 1.349 1.271 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.714 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.488 ' HA ' HG22 ' A' ' 62' ' ' VAL . 8.0 tt -69.07 -35.56 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 117.037 0.419 . . . . 0.0 110.903 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -36.29 74.66 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.211 0.529 . . . . 0.0 110.289 175.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.9 m -75.76 -44.43 41.63 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.593 177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.9 m -62.95 -32.42 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-N 119.381 0.991 . . . . 0.0 110.299 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.806 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -68.03 -50.58 54.47 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.383 1.073 . . . . 0.0 109.084 177.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.2 t -63.75 -31.52 72.73 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.093 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -107.5 16.57 23.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.133 0.973 . . . . 0.0 111.898 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -60.13 -52.68 71.64 Favored Pre-proline 0 CA--C 1.566 1.573 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.041 169.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -77.31 -6.13 16.2 Favored 'Trans proline' 0 C--N 1.399 3.226 0 C-N-CA 121.91 1.74 . . . . 0.0 112.435 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -96.22 82.33 3.43 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.69 -24.24 67.54 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.881 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -59.66 -29.99 68.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.885 0.874 . . . . 0.0 111.41 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -24.04 53.78 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.197 0.599 . . . . 0.0 111.384 -175.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -80.41 105.54 11.74 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -96.8 108.9 21.65 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.14 0.576 . . . . 0.0 109.856 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -78.26 117.55 19.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.387 0.675 . . . . 0.0 109.888 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -119.73 142.29 48.66 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.98 0.912 . . . . 0.0 110.398 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.4 m -94.76 111.29 23.08 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.22 154.62 12.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.236 1.014 . . . . 0.0 112.057 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.1 t -63.0 -17.45 62.18 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.024 0.93 . . . . 0.0 111.164 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.38 3.99 11.92 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.709 1.203 . . . . 0.0 111.839 174.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.77 0.06 87.31 Favored Glycine 0 C--N 1.354 1.535 0 C-N-CA 123.276 0.465 . . . . 0.0 112.778 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -87.73 165.29 15.47 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.029 0.931 . . . . 0.0 111.266 -172.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -113.82 129.17 56.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.366 0.666 . . . . 0.0 110.103 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -143.63 176.51 9.16 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.5 p90 -141.87 138.07 31.86 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 122.745 0.418 . . . . 0.0 110.212 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -99.31 166.94 10.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 169.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.621 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -135.1 121.3 20.15 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 -176.255 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -95.53 173.61 7.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.268 0.627 . . . . 0.0 111.864 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -135.87 174.28 10.79 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.67 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.26 -28.4 69.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.021 0.928 . . . . 0.0 111.386 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -85.97 6.9 26.57 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.556 0.742 . . . . 0.0 111.139 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 69.75 7.21 6.11 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.533 1.133 . . . . 0.0 111.606 -178.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.85 143.1 30.13 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.429 0.692 . . . . 0.0 110.678 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.8 mt -80.5 109.93 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.621 HD11 HD22 ' A' ' 86' ' ' LEU . 23.8 pt -91.42 -1.61 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 124.059 0.944 . . . . 0.0 112.26 -177.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.42 147.76 9.41 Favored Glycine 0 C--O 1.221 -0.695 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.6 p -154.81 129.07 8.98 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.675 0.79 . . . . 0.0 109.198 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.4 t -81.89 161.65 23.06 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -83.78 -78.43 0.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.796 0.438 . . . . 0.0 110.5 -171.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -168.22 121.67 0.89 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.225 0.61 . . . . 0.0 109.806 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -104.02 127.63 51.58 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.598 0.759 . . . . 0.0 109.68 173.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.37 -57.12 7.18 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.223 0.609 . . . . 0.0 109.702 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.498 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 38.8 p -85.5 125.57 33.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.703 174.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.7 -16.1 63.97 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.595 0.758 . . . . 0.0 112.276 -176.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.498 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 12.7 pt20 -65.17 -31.22 72.29 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.438 0.695 . . . . 0.0 110.977 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 m -72.79 -23.38 60.79 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.649 0.78 . . . . 0.0 111.085 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 110' ' ' ILE . 6.3 tmm_? -71.85 -40.72 68.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.66 0.784 . . . . 0.0 108.97 173.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.53 -50.49 71.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.805 0.842 . . . . 0.0 110.596 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.8 m -65.49 -29.97 70.68 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.208 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.9 -44.79 95.54 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.402 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 106' ' ' ARG . 37.3 mm -56.43 -49.18 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.401 0.68 . . . . 0.0 109.791 176.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.43 -36.25 82.34 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.793 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -72.1 -42.21 66.39 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.693 0.797 . . . . 0.0 110.52 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 71.0 t -70.19 -32.8 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.605 0.762 . . . . 0.0 110.76 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -67.46 -43.14 81.81 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.114 0.565 . . . . 0.0 110.572 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.15 -45.37 66.93 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.929 0.892 . . . . 0.0 111.47 -177.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.468 ' HB3' HD11 ' A' ' 35' ' ' LEU . 58.6 m-80 -93.88 -1.85 54.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.2 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.62 -29.62 65.37 Favored Glycine 0 C--N 1.343 0.922 0 N-CA-C 111.996 -0.441 . . . . 0.0 111.996 174.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.806 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 14.7 t -88.63 5.71 41.71 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.803 0.841 . . . . 0.0 111.664 177.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.4 m -82.59 109.28 16.64 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.109 0.564 . . . . 0.0 109.695 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -86.5 74.63 9.88 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 122.031 0.92 . . . . 0.0 108.781 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.0 m -147.12 94.72 2.45 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.094 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 m -105.28 140.32 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.514 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 28.9 mtmm -107.76 117.63 34.62 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 170.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.83 94.59 1.06 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 175.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.42 -18.8 40.6 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.678 178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 40.2 p -63.09 93.29 0.06 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.335 1.054 . . . . 0.0 110.827 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.5 -36.82 3.71 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.823 -175.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 46.8 m -74.9 109.2 8.16 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.354 0.662 . . . . 0.0 110.432 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 12.3 m120 . . . . . 0 C--O 1.248 1.006 0 C-N-CA 123.486 0.714 . . . . 0.0 109.319 178.398 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.477 0 N-CA-C 112.293 -0.323 . . . . 0.0 112.293 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.3 m -109.46 152.43 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.842 0.857 . . . . 0.0 109.568 174.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 16.2 pt -95.84 88.26 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 122.098 0.952 . . . . 0.0 110.822 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.93 107.79 18.87 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.959 173.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.31 149.09 30.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.311 0.644 . . . . 0.0 110.776 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.99 145.79 23.65 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.761 0.663 . . . . 0.0 111.99 175.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -130.94 151.32 51.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.526 0.73 . . . . 0.0 110.742 -175.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -90.26 155.02 19.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.543 168.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.592 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 41.3 mt-10 -132.46 124.5 28.7 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 31' ' ' PHE . 37.4 tp -79.7 99.5 7.44 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 p -106.57 156.85 18.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.28 1.432 . . . . 0.0 109.139 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.519 ' HB3' HG22 ' A' ' 126' ' ' THR . 21.6 ptmt -118.31 160.81 20.98 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.511 0.725 . . . . 0.0 109.869 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.3 t -120.39 177.81 4.89 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.457 0.703 . . . . 0.0 109.457 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -71.68 -8.52 54.65 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.142 0.577 . . . . 0.0 111.1 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.73 -4.2 33.06 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.201 1.0 . . . . 0.0 111.589 170.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 77.69 -12.94 1.01 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 125.614 1.565 . . . . 0.0 110.724 -178.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -83.5 156.62 22.75 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.218 1.007 . . . . 0.0 112.111 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.517 ' HB3' HD11 ' A' ' 23' ' ' LEU . 27.0 m-85 -97.7 151.55 20.02 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.172 -175.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -156.95 155.88 32.08 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.627 0.771 . . . . 0.0 109.442 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -102.3 131.53 48.82 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.017 0.527 . . . . 0.0 109.767 173.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.56 130.55 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.37 108.75 21.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -177.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -97.87 130.69 44.76 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.84 178.06 1.47 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.182 0.593 . . . . 0.0 110.806 172.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.58 -18.14 55.41 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-O 121.025 0.236 . . . . 0.0 113.261 174.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -74.21 -14.38 60.93 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 111.578 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.35 12.75 80.08 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.649 -172.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -98.38 124.31 42.98 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.529 0.732 . . . . 0.0 110.568 -175.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.6 m -70.48 121.51 17.91 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.1 pt -109.44 -34.75 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.038 0.935 . . . . 0.0 110.499 -178.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.7 tp -137.02 151.2 48.69 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -145.98 112.99 6.1 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.414 0.686 . . . . 0.0 110.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.4 m -58.39 156.18 10.65 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.983 0.913 . . . . 0.0 111.178 173.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.457 ' CG ' ' HB ' ' A' ' 93' ' ' ILE . 23.1 mm-40 -66.91 169.22 8.5 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.266 0.555 . . . . 0.0 111.917 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.34 111.95 11.14 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.612 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.483 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 63.8 m-85 -104.7 132.92 50.37 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.58 1.552 . . . . 0.0 109.31 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.6 p -62.07 -34.73 76.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.145 0.978 . . . . 0.0 111.589 -175.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m -122.45 152.82 39.88 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.57 1.148 . . . . 0.0 109.563 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -27.3 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.809 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.8 t -72.09 -28.23 63.16 Favored 'General case' 0 C--N 1.36 1.048 0 O-C-N 123.56 0.538 . . . . 0.0 111.35 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.483 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.3 m -71.38 -33.07 69.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.424 0.63 . . . . 0.0 109.79 174.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.21 -34.24 59.26 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.649 172.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -67.4 -42.69 82.9 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.423 1.089 . . . . 0.0 110.918 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.085 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.68 -49.84 74.17 Favored Glycine 0 C--N 1.356 1.662 0 O-C-N 123.987 0.805 . . . . 0.0 112.695 177.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -70.23 -35.86 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 122.196 0.198 . . . . 0.0 111.066 177.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.64 75.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.856 0.462 . . . . 0.0 110.746 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.9 m -76.0 -41.4 51.25 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.858 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -66.03 -30.82 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-N 119.028 0.831 . . . . 0.0 110.355 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -64.07 -39.63 94.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.139 1.375 . . . . 0.0 111.091 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 t -89.25 -28.49 19.89 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.315 0.646 . . . . 0.0 111.314 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -97.22 3.39 51.44 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.181 0.592 . . . . 0.0 112.076 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.643 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 11.7 p -69.43 -40.66 15.1 Favored Pre-proline 0 CA--C 1.568 1.66 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.854 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.48 -39.32 28.98 Favored 'Trans proline' 0 C--N 1.402 3.347 0 CA-C-N 121.484 1.566 . . . . 0.0 111.384 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -79.97 80.52 6.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.928 0.891 . . . . 0.0 110.235 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 12.4 pt-20 -68.13 -8.17 36.09 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.314 0.578 . . . . 0.0 111.868 174.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.64 -35.82 22.53 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.949 1.7 . . . . 0.0 112.217 165.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -85.28 -8.72 58.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.554 0.742 . . . . 0.0 112.41 -172.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -88.15 123.37 32.73 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.827 0.851 . . . . 0.0 109.179 177.704 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.7 96.79 9.23 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 170.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -85.58 121.53 28.4 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.556 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -145.23 142.5 29.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.457 0.703 . . . . 0.0 109.983 -173.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.6 m -99.82 130.05 45.98 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.145 0.578 . . . . 0.0 109.527 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.25 170.27 10.55 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.68 1.192 . . . . 0.0 111.845 178.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 m -64.55 -30.06 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.717 0.807 . . . . 0.0 111.464 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -72.77 -11.69 60.71 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.331 0.653 . . . . 0.0 112.146 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.17 18.4 53.56 Favored Glycine 0 C--N 1.344 0.996 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.558 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.5 mmtp -84.88 121.82 28.29 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.309 0.644 . . . . 0.0 110.222 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 100' ' ' TYR . 73.8 m-85 -80.76 133.96 35.74 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.431 0.692 . . . . 0.0 109.76 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -152.22 173.66 14.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.458 0.647 . . . . 0.0 110.202 173.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -147.16 142.57 27.46 Favored 'General case' 0 C--O 1.246 0.912 0 C-N-CA 124.89 1.276 . . . . 0.0 108.213 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -117.18 110.6 18.35 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 174.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.677 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -77.9 128.03 33.3 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 178.759 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.592 ' HE2' HG12 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -113.55 145.45 41.21 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.788 0.835 . . . . 0.0 110.126 -171.122 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.79 170.64 10.25 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.958 0.903 . . . . 0.0 109.613 171.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.98 61.27 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.156 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.13 2.56 56.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.092 0.957 . . . . 0.0 111.512 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 67.8 17.58 9.74 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.797 1.239 . . . . 0.0 112.439 -175.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -79.34 126.65 31.08 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.592 HG12 ' HE2' ' A' ' 87' ' ' LYS . 39.8 mt -73.58 96.87 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.677 HD11 HD22 ' A' ' 86' ' ' LEU . 13.9 pt -79.95 -13.33 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.86 -175.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -158.73 129.91 2.38 Favored Glycine 0 C--O 1.218 -0.853 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 173.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.3 t -134.2 112.43 11.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.8 p -71.0 140.42 50.81 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -77.12 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 124.277 0.986 . . . . 0.0 110.11 -168.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 20.8 ptp -171.61 134.67 0.84 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.258 1.023 . . . . 0.0 108.732 168.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.466 ' HB2' ' HB2' ' A' ' 82' ' ' PHE . 24.0 m-85 -105.13 136.65 44.24 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.062 0.945 . . . . 0.0 110.258 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -92.33 -24.83 18.8 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.114 0.566 . . . . 0.0 110.618 174.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.468 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 74.0 p -115.07 132.53 56.57 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.66 0.784 . . . . 0.0 110.049 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.05 -20.28 29.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.578 0.751 . . . . 0.0 110.941 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.468 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 14.0 pt20 -67.23 -33.77 76.07 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.861 0.864 . . . . 0.0 111.886 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.518 ' HB2' ' NH1' ' A' ' 106' ' ' ARG . 20.6 m -72.88 -18.46 61.42 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.111 0.564 . . . . 0.0 111.71 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.518 ' NH1' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER -59.99 -26.93 66.44 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.342 1.057 . . . . 0.0 112.473 178.416 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.5 -49.4 77.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.521 0.728 . . . . 0.0 110.472 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.5 m -76.23 -35.02 59.21 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.852 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.466 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -64.57 -51.94 47.55 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.874 -173.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.3 mm -59.17 -41.65 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 123.919 0.888 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.11 90.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.107 0.563 . . . . 0.0 110.967 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.3 t -73.77 -30.26 62.67 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.43 0.692 . . . . 0.0 111.721 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 109' ' ' GLY . 79.5 t -74.22 -35.5 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 122.567 0.347 . . . . 0.0 110.102 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 66' ' ' SER . 68.7 mttm -70.65 -48.1 56.63 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.474 0.31 . . . . 0.0 111.089 174.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.49 -51.14 31.05 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.59 0.756 . . . . 0.0 111.967 -174.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -95.92 -7.47 36.57 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.182 0.593 . . . . 0.0 111.483 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.27 -21.08 71.02 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.084 0.24 . . . . 0.0 112.873 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.9 p -81.74 -1.45 47.13 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.372 0.669 . . . . 0.0 111.748 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.2 m -75.25 135.48 40.97 Favored 'General case' 0 C--N 1.348 0.541 0 C-N-CA 122.711 0.404 . . . . 0.0 110.941 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -3.28 58.07 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.306 0.642 . . . . 0.0 110.47 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 35.3 m -65.86 101.93 0.71 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.215 1.006 . . . . 0.0 110.847 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 16.0 m -117.91 142.12 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.592 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 14.2 tmtt? -122.09 139.69 53.41 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.01 124.09 27.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.394 0.616 . . . . 0.0 111.659 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -132.63 -18.8 2.42 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.614 0.766 . . . . 0.0 109.944 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.519 HG22 ' HB3' ' A' ' 25' ' ' LYS . 8.4 p -62.66 101.09 0.22 Allowed 'General case' 0 C--N 1.36 1.062 0 C-N-CA 124.659 1.184 . . . . 0.0 111.004 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.32 -2.5 66.22 Favored Glycine 0 C--N 1.343 0.961 0 CA-C-N 115.582 -0.735 . . . . 0.0 113.21 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 m -86.59 73.23 10.11 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.7 m120 . . . . . 0 C--O 1.247 0.921 0 CA-C-N 114.843 -1.072 . . . . 0.0 108.511 -170.875 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.149 0 N-CA-C 112.28 -0.328 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.9 m -89.88 158.33 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 123.229 0.612 . . . . 0.0 109.467 174.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.4 pt -85.62 138.66 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.24 178.36 4.39 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.394 1.078 . . . . 0.0 109.362 176.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -132.08 122.9 26.16 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.513 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . 96.48 128.22 5.71 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.574 0.546 . . . . 0.0 113.326 174.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 31.7 p90 -137.49 148.65 46.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.063 0.945 . . . . 0.0 110.058 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -91.67 147.23 23.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.208 1.003 . . . . 0.0 108.859 170.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.549 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 42.9 mt-10 -133.75 116.37 15.67 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.471 0.709 . . . . 0.0 109.446 175.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' A' ' 31' ' ' PHE . 32.6 tp -83.25 99.51 10.02 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.381 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.9 p -108.84 147.59 31.88 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.329 1.052 . . . . 0.0 109.31 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' HG3' HG22 ' A' ' 126' ' ' THR . 9.9 mtmp? -95.78 143.69 26.8 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 173.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.5 p -86.73 -172.34 3.96 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.209 1.003 . . . . 0.0 111.159 -176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.27 -19.85 64.74 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 122.803 0.441 . . . . 0.0 110.437 171.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -84.11 -1.09 54.32 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.016 0.927 . . . . 0.0 111.948 174.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.5 t30 69.96 9.77 7.22 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 124.73 1.212 . . . . 0.0 110.702 -175.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -88.3 154.4 20.44 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.589 0.756 . . . . 0.0 111.448 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.581 ' HB3' HD11 ' A' ' 23' ' ' LEU . 94.4 m-85 -89.79 125.15 35.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.247 1.019 . . . . 0.0 110.568 -171.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -137.56 130.33 30.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.922 1.289 . . . . 0.0 108.936 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -91.3 132.48 36.12 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.138 0.575 . . . . 0.0 109.638 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.49 HG12 HG23 ' A' ' 45' ' ' THR . 25.8 m -113.71 131.05 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 167.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 26.0 tp -101.7 110.26 22.21 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 177.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 61.2 mttp -100.4 143.17 30.9 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.849 0.86 . . . . 0.0 108.89 172.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.26 173.44 4.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.209 0.604 . . . . 0.0 110.144 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.15 -19.04 61.16 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.638 -0.255 . . . . 0.0 112.992 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.04 -4.08 39.37 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.295 1.038 . . . . 0.0 112.362 175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.42 4.25 89.03 Favored Glycine 0 C--N 1.348 1.232 0 CA-C-O 120.891 0.162 . . . . 0.0 112.842 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -90.19 113.29 25.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.439 1.096 . . . . 0.0 109.24 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 22.1 m -61.84 129.52 41.34 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 122.837 0.455 . . . . 0.0 109.821 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.5 pt -115.8 -22.12 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 124.426 1.091 . . . . 0.0 110.581 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.4 tp -150.97 143.77 24.49 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.335 1.054 . . . . 0.0 108.319 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.49 HG23 HG12 ' A' ' 34' ' ' VAL . 96.3 m -139.55 112.15 7.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.6 0.76 . . . . 0.0 109.235 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.4 t -68.68 166.1 18.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.857 0.863 . . . . 0.0 110.542 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -89.27 -172.51 3.66 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.82 119.66 26.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.76 0.824 . . . . 0.0 110.984 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.0 m-85 -109.19 133.18 53.36 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.014 0.925 . . . . 0.0 108.95 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 70.3 p -61.04 -41.27 96.26 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.114 0.566 . . . . 0.0 110.972 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -119.73 148.48 43.36 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.321 1.048 . . . . 0.0 109.738 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 16.4 ptpt -68.31 -27.03 65.93 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.433 0.293 . . . . 0.0 110.948 177.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.1 p -55.71 -37.63 68.66 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.737 0.815 . . . . 0.0 111.311 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 12.6 m -70.29 -38.92 75.11 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.907 0.883 . . . . 0.0 110.448 174.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.59 -28.53 67.84 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.471 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 52' ' ' LYS . 67.3 mm-40 -68.35 -38.89 81.9 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.239 0.616 . . . . 0.0 109.916 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 -31.67 70.72 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.294 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -65.34 -49.15 62.69 Favored Glycine 0 C--N 1.344 0.99 0 O-C-N 123.975 0.797 . . . . 0.0 113.061 177.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.405 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.3 tt -72.52 -31.88 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 122.672 0.389 . . . . 0.0 110.977 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.9 85.4 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.673 0.389 . . . . 0.0 110.129 173.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.7 m -69.81 -47.15 63.88 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.836 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' GLY . 15.1 m -61.79 -34.22 61.44 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 CA-C-N 119.146 0.885 . . . . 0.0 111.618 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.29 -33.41 49.44 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 123.299 0.639 . . . . 0.0 109.727 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.7 t -75.18 -26.29 58.93 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.823 0.849 . . . . 0.0 111.097 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.18 0.63 43.76 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.266 1.026 . . . . 0.0 110.993 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.7 t -67.34 -40.0 24.1 Favored Pre-proline 0 CA--C 1.566 1.576 0 C-N-CA 123.007 0.523 . . . . 0.0 111.837 175.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -72.38 -23.85 20.06 Favored 'Trans proline' 0 C--N 1.39 2.723 0 C-N-CA 121.756 1.637 . . . . 0.0 113.229 166.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -79.94 90.87 5.36 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.914 0.485 . . . . 0.0 110.356 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 72' ' ' TYR . 11.6 pt-20 -64.93 -24.17 67.44 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.015 0.926 . . . . 0.0 111.776 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.29 -14.47 62.61 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.978 0.911 . . . . 0.0 112.557 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.436 ' HA ' ' HE ' ' A' ' 71' ' ' ARG . 7.7 mmp_? -91.14 -24.04 20.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.769 0.428 . . . . 0.0 110.762 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.422 ' HD2' ' HA ' ' A' ' 69' ' ' GLU . 89.6 m-85 -75.46 95.78 3.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.614 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -96.12 106.18 18.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.705 0.802 . . . . 0.0 109.857 -174.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.471 ' HB3' ' NE ' ' A' ' 106' ' ' ARG . 62.4 pttt -91.19 123.41 34.62 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.185 0.517 . . . . 0.0 111.223 -177.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.63 168.97 16.25 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.738 0.815 . . . . 0.0 109.494 175.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 7.4 m -100.4 112.65 25.02 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.23 163.05 1.23 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.464 1.106 . . . . 0.0 112.284 174.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 80.7 p -62.52 -20.26 64.44 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.373 0.669 . . . . 0.0 111.318 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -81.38 2.58 27.83 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.852 1.261 . . . . 0.0 111.882 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.33 19.3 79.64 Favored Glycine 0 C--N 1.353 1.49 0 C-N-CA 122.973 0.32 . . . . 0.0 113.455 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 99' ' ' MET . 73.3 mmtt -106.81 155.79 19.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.581 0.752 . . . . 0.0 110.125 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -104.76 128.85 53.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.878 0.471 . . . . 0.0 109.834 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.556 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 2.0 p90 -148.84 174.34 12.32 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.607 ' HB3' ' HE ' ' A' ' 106' ' ' ARG . 43.8 p90 -130.19 136.12 48.9 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.026 0.53 . . . . 0.0 111.805 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -103.45 115.37 30.41 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 170.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 24.0 tp -80.1 113.62 18.41 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 173.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.437 ' HE2' HG12 ' A' ' 93' ' ' ILE . 35.1 mmtp -97.39 164.11 12.59 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.005 0.922 . . . . 0.0 111.226 -175.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.79 175.27 5.55 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.253 1.021 . . . . 0.0 110.861 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.93 -26.07 65.79 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.131 0.972 . . . . 0.0 111.101 175.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -88.11 12.03 14.67 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.878 0.871 . . . . 0.0 110.946 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 65.2 15.77 10.19 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.821 1.248 . . . . 0.0 112.335 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -82.45 151.14 26.68 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.447 0.699 . . . . 0.0 110.13 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.437 HG12 ' HE2' ' A' ' 87' ' ' LYS . 46.9 mt -87.69 97.57 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.1 pt -85.45 -10.58 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.737 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -165.66 117.12 0.73 Allowed Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.6 p -103.89 113.95 27.85 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 169.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 37.5 t -73.66 166.54 23.09 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.203 0.525 . . . . 0.0 110.926 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -74.35 147.72 41.94 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.318 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.556 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.94 118.19 17.63 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -95.88 163.5 13.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.773 0.829 . . . . 0.0 110.666 -176.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.2 57.21 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.534 0.734 . . . . 0.0 111.253 -177.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.0 p -128.25 175.87 8.12 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.639 -178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.99 -20.52 61.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.025 0.93 . . . . 0.0 110.917 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -74.93 -42.76 57.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.832 0.853 . . . . 0.0 110.473 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.9 p -69.26 -22.11 63.85 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.822 0.449 . . . . 0.0 111.055 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.607 ' HE ' ' HB3' ' A' ' 84' ' ' PHE . 13.8 ttt180 -62.4 -41.81 98.96 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.626 0.37 . . . . 0.0 110.526 170.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -64.78 -36.1 83.24 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.256 0.622 . . . . 0.0 111.033 -177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.0 m -64.13 -36.85 85.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.881 171.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.88 -31.23 67.3 Favored Glycine 0 C--N 1.353 1.488 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.507 176.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.68 -49.57 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.93 -34.96 77.04 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.429 -1.259 . . . . 0.0 111.379 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t -69.1 -53.12 21.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.202 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.18 -31.56 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.628 0.771 . . . . 0.0 111.229 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -69.92 -50.5 41.5 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.362 0.665 . . . . 0.0 110.972 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.38 -19.25 36.42 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.394 0.678 . . . . 0.0 112.811 -173.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.513 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m120 -100.82 -30.77 11.51 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.647 0.779 . . . . 0.0 110.443 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.88 -17.26 77.53 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 116.089 -0.505 . . . . 0.0 113.62 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -71.18 -14.95 62.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.421 0.689 . . . . 0.0 111.65 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 98.2 p -65.68 -43.27 89.78 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 123.233 0.613 . . . . 0.0 110.223 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 59.25 19.78 7.89 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.705 1.202 . . . . 0.0 111.017 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.1 m -90.17 105.31 17.72 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.208 1.003 . . . . 0.0 109.457 -174.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.99 144.35 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 O-C-N 123.636 0.585 . . . . 0.0 110.895 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.549 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 25.8 mtpp -117.72 100.59 7.7 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 173.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.01 97.78 1.2 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.614 0.721 . . . . 0.0 109.49 -178.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.89 8.39 44.5 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.939 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.403 HG22 ' HG3' ' A' ' 25' ' ' LYS . 49.9 p -67.11 116.63 8.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.193 0.597 . . . . 0.0 109.505 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 112.58 -48.8 0.9 Allowed Glycine 0 C--N 1.346 1.092 0 N-CA-C 111.316 -0.713 . . . . 0.0 111.316 -175.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.4 m -88.8 74.95 8.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.332 0.653 . . . . 0.0 109.446 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.366 -172.782 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.437 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -83.47 153.77 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.13 0.572 . . . . 0.0 110.446 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.6 pt -105.67 170.06 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.469 0.708 . . . . 0.0 110.168 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.6 mmt -74.53 94.99 2.7 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 173.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.62 74.53 10.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.284 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.26 155.06 9.9 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.173 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 36.1 p90 -154.81 167.14 31.24 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.831 0.852 . . . . 0.0 109.228 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -110.11 133.88 52.75 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.336 0.654 . . . . 0.0 110.035 177.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -98.77 106.13 18.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 165.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.27 128.74 34.96 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -147.02 166.41 26.92 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.823 0.449 . . . . 0.0 109.802 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -109.33 141.33 41.82 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.567 0.747 . . . . 0.0 109.189 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -86.49 -168.58 2.29 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.826 0.851 . . . . 0.0 111.306 -176.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.2 m -60.23 -27.29 67.08 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.614 0.765 . . . . 0.0 112.375 -179.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.449 ' HB3' ' HG2' ' A' ' 30' ' ' GLN . 19.4 t70 -102.23 14.55 31.64 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.844 0.857 . . . . 0.0 110.494 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 62.04 17.84 9.42 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.567 1.147 . . . . 0.0 112.088 -173.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.449 ' HG2' ' HB3' ' A' ' 28' ' ' ASP . 33.5 mm-40 -71.54 141.69 50.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.474 0.71 . . . . 0.0 110.058 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -90.77 115.72 28.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.401 0.681 . . . . 0.0 109.879 -165.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.419 ' HB2' HD23 ' A' ' 48' ' ' LEU . 8.3 tpp180 -140.37 120.46 13.74 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.654 1.182 . . . . 0.0 108.36 -172.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -109.33 138.26 45.96 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.428 0.291 . . . . 0.0 110.345 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.57 132.8 54.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 173.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 13.8 tp -88.39 119.33 28.71 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -105.64 140.15 39.15 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.376 1.071 . . . . 0.0 109.076 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.24 178.5 5.09 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.373 0.669 . . . . 0.0 110.824 173.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -67.51 -17.29 68.55 Favored Glycine 0 C--N 1.35 1.35 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 174.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -66.77 -23.52 66.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.781 0.833 . . . . 0.0 110.946 170.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.35 -7.39 68.92 Favored Glycine 0 C--N 1.349 1.27 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.443 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -90.35 138.75 31.28 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.102 0.961 . . . . 0.0 110.531 -174.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.1 m -69.48 123.93 22.56 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.539 0.736 . . . . 0.0 110.889 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.9 pt -111.86 -19.87 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.578 1.151 . . . . 0.0 111.007 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -156.01 154.91 31.81 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -173.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 96.5 m -155.86 129.19 8.23 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 125.184 1.394 . . . . 0.0 107.793 -176.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 83.2 p -72.75 -170.89 0.76 Allowed 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.677 0.671 . . . . 0.0 111.718 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -91.88 178.51 5.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.734 0.413 . . . . 0.0 110.833 165.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' ' 32' ' ' ARG . 72.8 mt -77.08 113.69 15.07 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.012 174.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -89.72 141.24 28.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.949 170.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 46.3 p -83.2 -11.61 57.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.176 0.59 . . . . 0.0 110.866 176.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.8 m -135.1 135.74 41.43 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.214 1.006 . . . . 0.0 110.285 177.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -28.16 69.61 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.871 0.868 . . . . 0.0 111.401 175.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.6 p -70.2 -31.66 69.22 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.453 0.701 . . . . 0.0 111.092 175.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -70.87 -27.99 64.24 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.611 0.364 . . . . 0.0 110.54 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.15 67.39 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.54 0.736 . . . . 0.0 111.355 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.405 ' HA ' HG22 ' A' ' 59' ' ' ILE . 0.3 OUTLIER -74.23 -29.37 61.68 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 176.666 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.15 -37.27 86.85 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 166.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.41 -48.91 78.74 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.009 0.818 . . . . 0.0 113.438 -178.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 56' ' ' GLU . 10.5 tt -66.68 -33.59 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 120.878 0.371 . . . . 0.0 110.751 177.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.74 81.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.12 0.568 . . . . 0.0 110.703 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.1 m -75.55 -42.04 53.38 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.438 0.695 . . . . 0.0 111.878 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.9 m -66.06 -32.1 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.51 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 51.5 ttp180 -65.43 -47.06 77.51 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.417 1.087 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.3 t -64.1 -26.4 68.53 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.141 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -105.88 10.85 32.35 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.921 0.888 . . . . 0.0 112.511 -174.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.4 m -65.22 -46.87 72.26 Favored Pre-proline 0 CA--C 1.564 1.492 0 CA-C-O 118.525 -0.75 . . . . 0.0 112.054 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.79 -14.13 14.1 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.719 1.613 . . . . 0.0 112.763 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -80.12 94.62 6.02 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.276 0.63 . . . . 0.0 109.454 -177.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.04 -35.6 75.46 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.702 0.801 . . . . 0.0 111.881 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -61.5 -27.34 68.52 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.776 0.83 . . . . 0.0 111.71 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -87.57 -29.76 21.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -171.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.576 ' HB3' ' HG ' ' A' ' 86' ' ' LEU . 14.2 p90 -115.42 125.63 53.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 119.448 1.022 . . . . 0.0 109.161 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -137.91 137.76 38.35 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.515 0.726 . . . . 0.0 110.398 -173.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.455 ' HA ' ' HD1' ' A' ' 84' ' ' PHE . 2.3 ptmm? -76.62 105.12 7.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.251 171.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -91.35 164.68 13.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.707 1.203 . . . . 0.0 110.737 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -127.52 123.76 36.64 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.771 0.828 . . . . 0.0 108.885 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.12 165.54 20.11 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.435 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -60.48 -26.1 66.54 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.98 0.912 . . . . 0.0 111.46 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -84.37 -4.18 58.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.826 0.85 . . . . 0.0 111.636 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.02 62.12 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 122.91 0.291 . . . . 0.0 113.075 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 32.9 mmtp -71.98 129.94 39.76 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.269 0.627 . . . . 0.0 111.446 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -77.49 144.11 37.98 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.366 177.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -151.69 169.24 22.66 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 96' ' ' SER . 20.4 m-85 -105.25 160.13 15.33 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 122.12 -0.363 . . . . 0.0 110.079 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -140.23 103.78 4.67 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 168.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.576 ' HG ' ' HB3' ' A' ' 72' ' ' TYR . 1.4 tt -86.65 109.24 19.05 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -87.68 154.58 20.47 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.404 1.482 . . . . 0.0 110.655 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.46 166.3 10.65 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.55 1.14 . . . . 0.0 110.008 174.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -21.49 66.56 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.524 0.73 . . . . 0.0 111.661 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -86.09 10.69 13.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.123 0.969 . . . . 0.0 111.404 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.0 m80 62.85 25.29 15.01 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 177.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -115.08 156.77 24.58 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.212 1.005 . . . . 0.0 109.631 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.9 mt -87.72 121.28 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 122.818 0.447 . . . . 0.0 110.108 -176.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.6 pt -106.15 -4.95 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.071 0.948 . . . . 0.0 110.51 174.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -154.07 139.34 6.74 Favored Glycine 0 C--N 1.345 1.071 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 84' ' ' PHE . 77.8 p -159.47 169.72 23.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.221 1.408 . . . . 0.0 108.67 -177.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.4 t -132.87 165.39 24.74 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.553 -0.717 . . . . 0.0 110.537 174.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -72.5 -72.97 0.21 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.94 0.896 . . . . 0.0 109.454 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.562 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 22.5 ptp -175.87 139.87 0.41 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.301 1.04 . . . . 0.0 109.993 175.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -104.71 104.16 13.91 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.46 1.104 . . . . 0.0 108.863 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.58 -39.46 84.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.537 0.735 . . . . 0.0 110.893 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.7 p -90.01 133.6 34.72 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.857 173.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.1 -31.76 69.48 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.55 1.14 . . . . 0.0 112.673 -172.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.25 -28.58 68.83 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.458 0.703 . . . . 0.0 111.764 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 41.7 m -64.25 -22.44 66.95 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.882 0.873 . . . . 0.0 112.473 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.422 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.3 ptt180 -69.01 -39.56 79.22 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.37 -50.74 13.43 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.563 0.745 . . . . 0.0 110.103 -176.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.3 m -59.47 -38.35 80.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.994 0.918 . . . . 0.0 110.959 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.82 -35.66 92.18 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.252 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.429 HG23 ' HE2' ' A' ' 72' ' ' TYR . 26.4 mm -58.46 -48.3 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 CA-C-N 117.456 0.628 . . . . 0.0 110.852 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.64 -38.51 90.54 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.135 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -70.84 -42.96 69.47 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.01 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 70.5 t -65.78 -39.01 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.843 0.857 . . . . 0.0 110.391 179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -64.14 -39.46 94.06 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.674 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.23 -36.68 39.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.658 0.783 . . . . 0.0 112.59 -176.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.97 -8.84 17.38 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.074 0.55 . . . . 0.0 111.83 -169.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.04 -34.37 86.57 Favored Glycine 0 C--N 1.346 1.094 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.51 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 15.3 t -75.89 -5.75 47.56 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 124.01 0.924 . . . . 0.0 111.91 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.2 t -65.5 141.66 58.4 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.831 0.453 . . . . 0.0 109.808 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -121.44 8.2 10.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.342 1.057 . . . . 0.0 110.948 -172.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.2 t -97.04 115.84 28.18 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.39 131.33 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.825 0.85 . . . . 0.0 110.199 -178.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -92.32 110.28 21.67 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.631 0.772 . . . . 0.0 109.17 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -83.44 102.86 12.35 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.986 0.898 . . . . 0.0 110.159 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -91.77 -3.38 56.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.512 1.125 . . . . 0.0 110.21 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 27.0 p -73.17 109.09 6.44 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.034 0.933 . . . . 0.0 110.882 178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 87.92 24.7 34.25 Favored Glycine 0 C--N 1.347 1.163 0 CA-C-N 116.149 -0.478 . . . . 0.0 113.435 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.2 m -67.78 103.19 1.36 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.912 0.485 . . . . 0.0 111.077 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 39.2 t30 . . . . . 0 C--O 1.25 1.118 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 171.205 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 112.053 -0.419 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.2 m -112.06 145.58 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.807 0.843 . . . . 0.0 110.303 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.0 pt -72.25 127.12 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 0.0 109.532 173.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptm -163.57 161.97 24.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.885 0.474 . . . . 0.0 110.83 -172.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.08 149.82 25.52 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.878 0.871 . . . . 0.0 110.316 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.51 135.58 4.17 Favored Glycine 0 C--N 1.341 0.855 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.239 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -153.05 150.61 29.34 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 123.873 0.869 . . . . 0.0 110.136 -178.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -87.05 143.46 27.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.213 177.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -129.71 111.72 12.93 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.0 tp -79.68 98.37 6.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.2 m -105.92 136.22 45.95 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.241 -170.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HB3' HG22 ' A' ' 126' ' ' THR . 19.4 ptmt -94.75 133.34 38.55 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 170.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 45.9 m -79.29 179.52 7.36 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.648 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.0 t -58.2 -37.98 75.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.046 0.538 . . . . 0.0 111.458 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -92.55 22.52 4.6 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 123.811 0.845 . . . . 0.0 110.77 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 64.31 19.59 11.85 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.513 1.125 . . . . 0.0 112.817 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.401 ' HB2' HD12 ' A' ' 48' ' ' LEU . 88.2 mm-40 -77.59 120.75 22.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.16 0.584 . . . . 0.0 109.692 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 49' ' ' TYR . 50.1 m-85 -89.52 124.2 34.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.645 0.778 . . . . 0.0 109.594 -170.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.605 ' HB2' ' HB2' ' A' ' 46' ' ' SER . 35.9 ptt180 -157.29 158.09 35.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.353 0.661 . . . . 0.0 109.877 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.51 ' HE2' HG23 ' A' ' 122' ' ' VAL . 16.7 m-85 -91.31 141.23 29.0 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.93 0.492 . . . . 0.0 109.805 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.409 HG12 HG23 ' A' ' 45' ' ' THR . 19.8 m -120.67 131.26 73.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 167.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -97.34 111.8 23.89 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -90.41 138.29 31.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.5 176.0 5.07 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.481 0.712 . . . . 0.0 110.135 169.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -60.19 -24.36 60.94 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 114.088 0.395 . . . . 0.0 114.088 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -81.26 0.4 36.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.291 1.037 . . . . 0.0 112.173 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.3 -0.71 89.55 Favored Glycine 0 C--N 1.353 1.512 0 C-N-CA 122.803 0.24 . . . . 0.0 113.599 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -88.21 130.56 35.04 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.455 0.702 . . . . 0.0 110.336 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.8 m -71.95 121.9 19.89 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.294 0.638 . . . . 0.0 110.287 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 pt -102.58 -32.08 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.452 1.101 . . . . 0.0 110.815 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 34.6 tp -132.18 149.45 52.39 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.993 0.917 . . . . 0.0 109.662 -172.438 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.409 HG23 HG12 ' A' ' 34' ' ' VAL . 91.6 m -152.99 125.77 8.35 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.411 1.084 . . . . 0.0 109.462 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.605 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 5.6 m -66.97 170.79 6.2 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.011 0.924 . . . . 0.0 110.583 175.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.1 168.11 20.62 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.7 mm? -71.3 112.48 7.47 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 84.9 m-85 -104.95 137.16 43.14 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 m -73.99 -28.74 61.61 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.161 0.505 . . . . 0.0 110.092 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.497 ' HB3' HG22 ' A' ' 53' ' ' THR . 17.6 m -105.32 132.59 51.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.624 0.77 . . . . 0.0 110.151 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -26.84 62.12 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.231 0.613 . . . . 0.0 111.316 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.497 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -62.09 -36.41 81.62 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.751 0.657 . . . . 0.0 110.89 174.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 m -65.83 -39.06 90.46 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 110.819 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.26 86.39 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.601 0.76 . . . . 0.0 110.455 174.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.64 -34.2 77.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.742 0.817 . . . . 0.0 110.839 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 53' ' ' THR . 64.1 mmtt -76.53 -30.33 57.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.28 -41.61 98.42 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 114.062 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -65.66 -42.32 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 117.112 0.456 . . . . 0.0 111.035 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.11 -36.28 83.79 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.967 0.507 . . . . 0.0 110.74 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.3 m -71.66 -46.03 60.16 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.695 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 33.6 m -67.15 -28.97 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 118.204 0.456 . . . . 0.0 110.8 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -69.21 -38.47 78.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.342 0.657 . . . . 0.0 110.491 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.5 t -76.31 -36.83 58.12 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.855 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -93.0 8.44 39.89 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.18 0.992 . . . . 0.0 111.465 -176.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.493 ' OG ' ' HA ' ' A' ' 114' ' ' LYS . 16.9 t -62.33 -44.94 89.73 Favored Pre-proline 0 CA--C 1.571 1.762 0 C-N-CA 124.709 1.203 . . . . 0.0 112.222 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.81 -6.73 6.62 Favored 'Trans proline' 0 C--N 1.393 2.904 0 C-N-CA 121.845 1.696 . . . . 0.0 113.479 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -83.89 85.75 7.27 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.99 0.516 . . . . 0.0 110.112 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.33 -23.3 67.35 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.864 0.866 . . . . 0.0 112.593 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -66.79 -34.9 78.84 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.649 0.78 . . . . 0.0 111.189 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -76.36 -20.9 56.75 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.11 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -73.21 116.21 13.48 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -96.24 98.38 10.26 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 147.43 38.82 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.946 0.403 . . . . 0.0 110.139 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -144.62 167.96 21.29 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.916 1.287 . . . . 0.0 109.129 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.4 m -126.73 114.73 18.37 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.278 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.11 154.7 5.33 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.855 1.262 . . . . 0.0 111.221 172.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 p -68.92 -12.94 62.11 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.631 0.772 . . . . 0.0 112.266 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -79.74 1.83 25.14 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.55 0.74 . . . . 0.0 111.948 170.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.48 10.59 84.3 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.172 0.295 . . . . 0.0 112.874 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -88.35 141.33 28.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.609 0.764 . . . . 0.0 110.154 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -101.77 128.56 48.05 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.964 0.506 . . . . 0.0 110.119 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.616 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 30.0 p90 -142.75 175.52 9.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -133.96 158.79 42.59 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 122.966 0.506 . . . . 0.0 110.153 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -127.05 100.72 6.24 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.505 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.27 111.54 18.44 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 173.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HE2' HG12 ' A' ' 93' ' ' ILE . 16.2 ptpt -127.93 155.37 44.32 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.558 0.343 . . . . 0.0 110.177 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.47 178.79 6.45 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.464 0.705 . . . . 0.0 110.692 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.28 -10.81 57.33 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.499 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.515 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 2.0 m-20 -80.86 5.4 16.17 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.295 1.038 . . . . 0.0 111.621 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 67.8 11.27 8.29 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.805 1.242 . . . . 0.0 111.976 -178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 4.0 pt20 -106.87 135.11 48.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.781 0.433 . . . . 0.0 110.955 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.422 HG12 ' HE2' ' A' ' 87' ' ' LYS . 55.9 mt -70.85 99.47 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 123.922 0.889 . . . . 0.0 110.131 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.505 HD11 HD22 ' A' ' 86' ' ' LEU . 18.3 pt -79.05 -12.91 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.313 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.44 146.54 9.58 Favored Glycine 0 C--O 1.215 -1.035 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.1 p -166.7 167.16 15.45 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 117.743 0.771 . . . . 0.0 109.772 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.2 t -113.75 165.25 12.74 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -76.78 -54.57 6.45 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.616 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 26.7 ptt? 174.33 131.52 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.75 1.62 . . . . 0.0 108.402 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.549 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 97.3 m-85 -98.28 156.87 16.51 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.072 0.549 . . . . 0.0 109.941 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.65 64.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.822 0.849 . . . . 0.0 111.213 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.5 p -130.39 177.1 7.59 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.54 0.736 . . . . 0.0 110.623 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.37 -28.56 65.21 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.845 172.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -61.82 -40.58 95.79 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.292 0.637 . . . . 0.0 110.572 172.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.549 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 14.6 m -68.55 -35.64 77.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.786 178.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -68.34 -46.14 70.99 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.969 0.508 . . . . 0.0 111.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.09 -28.59 65.53 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.779 0.432 . . . . 0.0 111.357 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 m -64.41 -40.58 96.06 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 168.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.68 99.63 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.785 175.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.9 mm -60.4 -48.88 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.714 0.805 . . . . 0.0 110.258 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.29 83.2 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.298 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.97 -37.55 61.9 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.695 -178.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.57 -30.69 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 123.288 0.635 . . . . 0.0 110.13 176.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HA ' ' OG ' ' A' ' 66' ' ' SER . 37.9 ttpt -70.23 -45.1 67.2 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 120.929 0.395 . . . . 0.0 110.81 172.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.69 -28.74 66.1 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.847 0.859 . . . . 0.0 111.924 -177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.78 -10.23 14.79 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.654 0.781 . . . . 0.0 111.415 -174.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.1 -23.79 75.22 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 112.024 -0.431 . . . . 0.0 112.024 175.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 25.4 p -78.45 -0.52 29.64 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.285 1.034 . . . . 0.0 112.406 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.6 t -70.85 135.69 48.23 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.482 0.713 . . . . 0.0 110.847 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -90.7 -16.48 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 110.335 175.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.5 m -73.98 93.16 2.19 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.752 0.821 . . . . 0.0 110.892 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.51 HG23 ' HE2' ' A' ' 33' ' ' PHE . 2.0 p -96.63 132.99 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -126.23 106.6 9.65 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.899 0.88 . . . . 0.0 109.211 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.68 101.85 3.77 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.119 0.568 . . . . 0.0 110.86 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -76.26 -26.25 55.77 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 123.827 0.851 . . . . 0.0 109.977 169.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.52 HG22 ' HB3' ' A' ' 25' ' ' LYS . 31.3 p -62.42 143.25 57.28 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.323 1.049 . . . . 0.0 110.95 177.303 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.8 -10.33 18.59 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.825 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 34.3 p -90.69 159.48 16.35 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.318 1.047 . . . . 0.0 110.774 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 7.9 t30 . . . . . 0 C--O 1.248 1.001 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 174.943 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.604 0 N-CA-C 111.756 -0.538 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.8 m -87.37 160.9 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 123.808 0.843 . . . . 0.0 110.531 179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -64.83 154.43 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.716 0.807 . . . . 0.0 111.069 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -67.62 129.67 40.64 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.578 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.07 104.79 11.91 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -85.2 -168.84 45.24 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 116.001 -0.545 . . . . 0.0 113.257 -175.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 29.5 p90 -141.08 148.75 40.65 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 123.319 0.647 . . . . 0.0 110.368 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.434 ' HB3' ' HD1' ' A' ' 33' ' ' PHE . 85.6 m-85 -98.41 120.29 38.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.943 175.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.443 ' HG2' ' HD3' ' A' ' 123' ' ' LYS . 44.5 mt-10 -92.62 114.09 26.55 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 173.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 31' ' ' PHE . 52.4 tp -80.61 96.63 6.91 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 172.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.7 p -105.04 148.54 26.66 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.134 1.373 . . . . 0.0 109.826 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -102.1 160.25 14.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.51 0.724 . . . . 0.0 111.13 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 96.5 p -89.94 -175.46 4.6 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 166.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.3 p -64.03 -20.21 65.75 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.082 0.553 . . . . 0.0 111.338 172.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -103.01 17.67 23.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.279 1.032 . . . . 0.0 111.339 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 64.74 16.48 10.43 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.841 1.257 . . . . 0.0 112.683 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -72.96 138.51 46.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.074 0.549 . . . . 0.0 110.066 -179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.523 ' HB3' HD11 ' A' ' 23' ' ' LEU . 77.7 m-85 -89.43 133.95 34.31 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.129 0.972 . . . . 0.0 110.159 -166.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB2' HD13 ' A' ' 48' ' ' LEU . 24.4 ttp180 -148.75 120.72 8.21 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -172.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HB3' ' A' ' 21' ' ' PHE . 23.5 m-85 -90.2 124.1 34.57 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.435 HG12 HG23 ' A' ' 45' ' ' THR . 35.4 m -111.18 131.71 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 21.7 tp -100.3 116.43 32.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 95.7 mttt -101.58 128.07 48.0 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 170.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.403 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.14 166.75 7.35 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.948 0.78 . . . . 0.0 111.349 175.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.57 -2.5 35.83 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-N 115.818 -0.628 . . . . 0.0 114.571 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -86.7 -14.0 43.78 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.505 0.722 . . . . 0.0 110.64 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.34 -5.64 41.55 Favored Glycine 0 C--N 1.351 1.405 0 C-N-CA 123.592 0.615 . . . . 0.0 113.758 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -97.46 139.86 32.76 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.295 0.638 . . . . 0.0 110.713 -176.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 20.5 m -67.41 143.81 56.1 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.044 0.938 . . . . 0.0 109.822 174.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.403 HD13 ' HB2' ' A' ' 37' ' ' ALA . 20.8 pt -132.43 -20.5 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.961 0.905 . . . . 0.0 111.362 -176.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -152.5 149.39 28.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.426 0.69 . . . . 0.0 109.498 -170.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.435 HG23 HG12 ' A' ' 34' ' ' VAL . 72.1 m -148.79 117.93 6.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.197 0.999 . . . . 0.0 109.273 177.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.8 t -79.33 172.49 13.72 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.391 0.676 . . . . 0.0 111.062 177.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.42 173.64 9.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.147 0.579 . . . . 0.0 111.649 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.4 mm? -82.83 111.36 18.66 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.482 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.6 m-85 -88.72 131.13 35.16 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.822 1.249 . . . . 0.0 109.164 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -66.49 -30.24 70.53 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.727 0.811 . . . . 0.0 111.414 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.6 m -125.52 143.97 50.76 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.709 0.804 . . . . 0.0 110.446 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.95 68.64 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.818 0.847 . . . . 0.0 111.017 175.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.5 p -62.05 -43.08 99.61 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.38 1.072 . . . . 0.0 110.793 176.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.482 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 8.3 m -65.52 -37.86 87.99 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.153 0.981 . . . . 0.0 110.073 178.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.9 -38.53 88.96 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.943 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.7 -39.66 94.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.08 0.552 . . . . 0.0 110.564 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.93 -37.52 86.26 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.575 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.4 76.36 Favored Glycine 0 C--N 1.35 1.334 0 O-C-N 123.878 0.736 . . . . 0.0 112.868 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.451 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.0 tt -72.04 -31.71 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 122.849 0.459 . . . . 0.0 111.118 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.42 87.24 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.99 0.516 . . . . 0.0 110.356 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.4 m -70.4 -52.14 24.51 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.955 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 59' ' ' ILE . 21.3 m -58.26 -33.05 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 122.585 0.354 . . . . 0.0 111.85 -173.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -66.99 -43.18 83.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.868 0.867 . . . . 0.0 110.799 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.6 t -69.59 -36.06 75.9 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.285 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.432 ' HB3' HD21 ' A' ' 86' ' ' LEU . 13.4 m120 -88.26 -0.42 57.1 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.027 0.931 . . . . 0.0 111.979 -174.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.656 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.5 m -55.03 -52.13 73.7 Favored Pre-proline 0 CA--C 1.565 1.534 0 C-N-CA 123.773 0.829 . . . . 0.0 112.425 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -81.26 -12.53 11.58 Favored 'Trans proline' 0 C--N 1.392 2.818 0 C-N-CA 121.914 1.743 . . . . 0.0 113.034 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -85.62 86.64 7.36 Favored 'General case' 0 C--N 1.351 0.646 0 C-N-CA 123.468 0.707 . . . . 0.0 109.979 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -62.54 -21.77 65.8 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.622 0.769 . . . . 0.0 111.459 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.539 ' HG3' ' HE ' ' A' ' 71' ' ' ARG . 11.7 tp10 -52.8 -36.28 58.11 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.319 1.448 . . . . 0.0 111.634 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HE ' ' HG3' ' A' ' 70' ' ' GLU . 5.1 mmp_? -90.27 0.77 57.07 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.58 0.752 . . . . 0.0 112.884 -174.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -99.48 134.13 42.8 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.911 0.484 . . . . 0.0 110.204 175.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 16.7 mm-40 -100.09 92.93 5.47 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.212 1.005 . . . . 0.0 108.363 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -89.1 101.36 14.02 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.745 0.783 . . . . 0.0 108.961 -176.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -136.16 173.22 11.95 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.698 0.799 . . . . 0.0 110.543 -170.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -120.98 128.01 52.32 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.744 0.817 . . . . 0.0 109.924 -176.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.0 160.43 32.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.726 0.811 . . . . 0.0 109.882 169.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.0 m -65.38 -10.96 37.7 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.196 0.598 . . . . 0.0 112.264 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -76.27 -5.18 45.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.038 0.935 . . . . 0.0 111.385 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.42 9.24 85.16 Favored Glycine 0 C--N 1.351 1.4 0 C-N-CA 123.306 0.479 . . . . 0.0 112.197 -174.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.426 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -97.22 132.81 42.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.242 0.617 . . . . 0.0 111.115 -173.313 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.659 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 62.4 m-85 -94.59 133.89 37.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.322 1.049 . . . . 0.0 110.597 -173.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -145.31 174.8 10.79 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.86 0.864 . . . . 0.0 109.245 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 24.9 p90 -138.69 134.26 33.39 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.277 0.631 . . . . 0.0 110.198 174.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.564 ' HB3' HD12 ' A' ' 93' ' ' ILE . 95.3 m-20 -110.04 120.6 42.96 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.574 0.75 . . . . 0.0 109.402 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.2 129.3 34.8 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.808 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -105.5 137.06 43.95 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.45 1.1 . . . . 0.0 110.448 -168.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.23 169.69 8.3 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.509 0.723 . . . . 0.0 110.082 173.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.59 -21.4 66.33 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.797 0.839 . . . . 0.0 111.904 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.411 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 11.5 m120 -85.79 4.67 35.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.811 0.844 . . . . 0.0 111.784 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.5 m170 70.73 -1.16 2.7 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.276 1.43 . . . . 0.0 112.82 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 30.0 pt20 -75.99 149.33 37.61 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 123.168 0.587 . . . . 0.0 110.467 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 85' ' ' ASN . 41.4 mm -87.37 99.59 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 12.5 pt -79.14 -4.79 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.83 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.16 94.16 0.1 OUTLIER Glycine 0 C--N 1.342 0.871 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.6 p -88.52 125.87 34.98 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.418 ' HB3' ' H ' ' A' ' 84' ' ' PHE . 38.3 t -79.27 169.99 17.29 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 121.675 0.75 . . . . 0.0 110.948 -178.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.41 150.91 39.78 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.119 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 16.5 ptm -76.55 116.5 17.29 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.436 ' HB3' ' OG ' ' A' ' 105' ' ' SER . 62.9 m-85 -102.91 153.16 20.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.856 0.862 . . . . 0.0 111.291 -173.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.85 -52.39 11.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.036 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.2 p -104.18 163.87 12.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.093 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.01 -27.51 61.82 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.05 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.5 -42.13 95.7 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.445 0.698 . . . . 0.0 111.278 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.436 ' OG ' ' HB3' ' A' ' 100' ' ' TYR . 34.5 p -73.29 -30.79 63.64 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.198 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.659 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 27.0 ptt180 -76.87 -36.3 56.86 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.07 0.395 . . . . 0.0 111.446 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.24 -29.87 60.35 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.884 0.373 . . . . 0.0 110.76 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.9 m -69.35 -33.88 73.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.53 167.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.22 -37.38 94.46 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.535 173.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.9 mm -59.82 -48.34 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 174.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.47 -36.23 79.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.361 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -71.25 -52.13 20.68 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.154 0.582 . . . . 0.0 110.831 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.72 -31.05 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.542 0.737 . . . . 0.0 110.928 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.656 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 27.6 ttpp -70.04 -39.47 75.73 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.627 0.771 . . . . 0.0 111.527 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.91 -47.7 43.53 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.495 0.718 . . . . 0.0 111.56 -178.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.06 -20.16 19.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -169.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -69.76 -27.01 73.76 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 123.322 0.389 . . . . 0.0 113.164 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.626 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 72.5 p -67.66 -30.35 69.87 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.646 0.778 . . . . 0.0 111.436 176.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.3 m -83.58 88.05 7.03 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.749 0.82 . . . . 0.0 109.89 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.87 62.53 5.71 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.54 0.686 . . . . 0.0 110.789 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.8 t -101.81 110.72 22.76 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 173.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.9 t -96.42 114.5 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.689 0.796 . . . . 0.0 110.846 -171.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.443 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 84.8 tttt -83.57 115.54 22.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.06 0.944 . . . . 0.0 108.483 166.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -73.86 131.69 41.75 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 0.0 110.287 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -138.91 -8.1 1.39 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.069 0.948 . . . . 0.0 110.395 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.1 p -71.84 91.51 1.17 Allowed 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.084 0.468 . . . . 0.0 110.211 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.43 -6.72 20.84 Favored Glycine 0 C--N 1.349 1.265 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.548 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.1 t -123.67 122.84 39.16 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.862 0.865 . . . . 0.0 109.665 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.8 p30 . . . . . 0 CA--C 1.563 1.452 0 C-N-CA 124.08 0.952 . . . . 0.0 112.39 -179.1 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.414 0 N-CA-C 111.694 -0.562 . . . . 0.0 111.694 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.99 156.36 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.241 0.616 . . . . 0.0 110.408 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.7 pt -76.2 166.51 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.61 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 49.5 mtt -75.02 133.16 41.71 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.11 118.91 19.35 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 63.33 -154.3 45.03 Favored Glycine 0 C--N 1.349 1.274 0 O-C-N 123.929 0.768 . . . . 0.0 113.657 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.4 p90 -162.75 165.87 24.98 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.753 0.821 . . . . 0.0 110.683 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 69.1 m-85 -105.44 157.58 17.25 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.534 1.134 . . . . 0.0 108.731 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.494 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 74.8 mt-10 -137.18 110.09 7.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 169.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.7 tp -92.82 106.14 18.15 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 m -129.35 152.0 49.38 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HE3' ' HB ' ' A' ' 126' ' ' THR . 19.1 ptpt -106.51 148.59 28.03 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.038 0.446 . . . . 0.0 110.4 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -72.4 -178.03 2.4 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.345 1.058 . . . . 0.0 111.264 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.0 t -66.74 -29.74 69.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 122.875 0.47 . . . . 0.0 111.247 -178.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -86.52 15.15 5.78 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.026 0.53 . . . . 0.0 111.585 174.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.446 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 17.3 m120 68.68 14.03 8.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.912 1.285 . . . . 0.0 112.748 171.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.48 134.23 35.5 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.605 0.762 . . . . 0.0 109.272 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -86.97 140.52 29.5 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.544 0.738 . . . . 0.0 110.134 -169.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -152.72 115.7 4.6 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -93.35 138.2 31.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.56 HG12 HG23 ' A' ' 45' ' ' THR . 30.4 m -110.8 153.77 12.52 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 172.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 116' ' ' ASN . 0.4 OUTLIER -117.35 123.16 45.81 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.443 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -119.76 146.24 45.83 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 110.359 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -75.4 -178.71 4.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.77 0.828 . . . . 0.0 110.552 172.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -66.14 -17.98 66.47 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.562 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -88.33 -2.37 58.56 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.906 0.882 . . . . 0.0 112.192 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.37 2.82 88.98 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 113.989 0.355 . . . . 0.0 113.989 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -81.68 126.76 32.17 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.029 0.531 . . . . 0.0 110.095 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.1 m -70.09 120.63 16.08 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 pt -100.25 -26.49 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.965 1.306 . . . . 0.0 111.016 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.8 tp -151.54 120.93 6.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.368 0.667 . . . . 0.0 109.395 -174.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.56 HG23 HG12 ' A' ' 34' ' ' VAL . 59.4 m -119.63 122.07 40.71 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.417 0.687 . . . . 0.0 109.543 176.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.506 ' HG ' ' HE2' ' A' ' 49' ' ' TYR . 16.5 t -73.93 -176.28 2.43 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 122.764 0.426 . . . . 0.0 110.569 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -91.94 178.19 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.72 0.408 . . . . 0.0 110.469 172.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.6 mp -84.47 112.42 20.36 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -178.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.506 ' HE2' ' HG ' ' A' ' 46' ' ' SER . 82.1 m-85 -90.33 115.85 27.84 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.145 0.978 . . . . 0.0 108.569 170.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.4 p -69.97 -7.73 43.14 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.01 0.524 . . . . 0.0 111.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.9 m -119.33 135.31 54.78 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.546 1.138 . . . . 0.0 109.738 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -29.36 69.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.929 0.492 . . . . 0.0 110.655 174.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -63.98 -43.78 94.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.125 0.97 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.7 p -74.41 -28.27 61.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.176 0.59 . . . . 0.0 111.362 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.58 -36.01 82.5 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.95 0.5 . . . . 0.0 110.616 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -73.17 -37.19 66.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.578 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -61.07 -39.98 91.94 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.499 172.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.01 85.24 Favored Glycine 0 C--N 1.348 1.244 0 O-C-N 123.867 0.73 . . . . 0.0 113.226 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.2 tt -71.39 -32.0 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 CA-C-O 120.925 0.393 . . . . 0.0 111.0 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 -30.96 70.26 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.799 0.44 . . . . 0.0 110.557 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 m -74.06 -43.32 58.22 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.087 178.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.27 -27.95 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 CA-C-N 118.276 0.489 . . . . 0.0 110.521 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.29 -44.32 79.53 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.648 0.779 . . . . 0.0 109.498 176.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -78.08 -26.64 48.26 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.0 0.52 . . . . 0.0 111.497 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -103.26 13.68 33.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.88 0.872 . . . . 0.0 111.381 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 57.4 p -66.92 -45.89 54.03 Favored Pre-proline 0 CA--C 1.565 1.537 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.828 173.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.29 -7.07 15.97 Favored 'Trans proline' 0 C--N 1.397 3.097 0 CA-C-N 121.873 1.705 . . . . 0.0 112.433 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -83.1 77.16 9.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.537 0.735 . . . . 0.0 110.373 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -60.6 -35.82 77.06 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.703 1.201 . . . . 0.0 112.362 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -74.87 -23.9 58.47 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.272 0.629 . . . . 0.0 110.969 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -77.19 -21.37 54.04 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 123.341 0.657 . . . . 0.0 110.649 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -73.87 104.61 4.81 Favored 'General case' 0 C--N 1.356 0.886 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 167.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -96.86 113.23 24.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.282 0.633 . . . . 0.0 109.292 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 147.05 34.03 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 173.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -147.58 135.59 21.28 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.278 1.031 . . . . 0.0 108.954 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.7 m -98.32 125.19 43.34 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.07 164.85 26.1 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.025 0.93 . . . . 0.0 110.893 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -69.17 -26.37 64.82 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.435 0.694 . . . . 0.0 110.341 178.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -76.35 -4.64 43.33 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.43 1.092 . . . . 0.0 111.244 174.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.44 10.07 74.53 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.868 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -81.44 122.46 27.54 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 122.993 0.517 . . . . 0.0 110.306 -177.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -88.36 126.79 35.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -147.57 175.34 10.93 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -127.0 161.59 28.01 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.381 0.672 . . . . 0.0 110.503 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -140.42 124.19 17.24 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.439 1.096 . . . . 0.0 108.404 176.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.0 tp -84.57 106.59 16.25 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 172.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 91' ' ' HIS . 2.8 tmtm? -86.38 150.13 24.53 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.9 34.38 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.244 0.617 . . . . 0.0 110.365 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.53 -14.48 51.56 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.463 0.705 . . . . 0.0 111.931 177.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -85.94 14.82 5.57 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 0.0 111.475 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.419 ' HA ' ' HE3' ' A' ' 87' ' ' LYS . 71.8 m80 67.07 19.13 10.53 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.905 1.282 . . . . 0.0 112.164 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -109.76 147.45 33.2 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.682 0.793 . . . . 0.0 109.914 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.9 mm -90.12 105.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 170.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.7 pt -87.55 -7.87 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.16 145.71 9.08 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 123.407 0.442 . . . . 0.0 112.605 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -154.45 122.38 5.92 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.205 1.402 . . . . 0.0 108.917 174.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.8 p -67.89 153.74 43.07 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 172.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -60.59 -78.59 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.815 0.697 . . . . 0.0 111.169 -174.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.409 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 24.9 ptt? -173.28 121.97 0.37 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.389 1.076 . . . . 0.0 108.966 176.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -103.27 148.94 25.21 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.71 -37.53 35.47 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.636 174.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.6 p -114.45 147.76 38.81 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.357 0.663 . . . . 0.0 111.76 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.63 -22.45 64.41 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.535 176.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -58.82 -45.11 90.73 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.69 0.796 . . . . 0.0 111.164 173.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m -73.0 -23.99 60.7 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.363 0.665 . . . . 0.0 111.29 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.445 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.9 mtp180 -62.69 -51.11 68.48 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.663 0.385 . . . . 0.0 110.28 168.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -66.54 -34.61 78.29 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.943 0.897 . . . . 0.0 111.061 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.7 m -70.32 -34.68 72.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.929 0.492 . . . . 0.0 109.936 174.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.484 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.14 -50.68 64.59 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.448 173.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 106' ' ' ARG . 40.7 mm -56.4 -45.28 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.244 1.018 . . . . 0.0 110.065 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.84 89.5 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.821 0.848 . . . . 0.0 110.849 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.5 t -73.16 -34.94 66.33 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.763 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 109' ' ' GLY . 75.4 t -69.31 -37.28 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.139 0.576 . . . . 0.0 110.943 -178.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 66' ' ' SER . 10.4 mtmp? -69.93 -37.81 76.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.726 0.41 . . . . 0.0 110.616 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.62 76.19 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.71 177.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.446 ' N ' HD21 ' A' ' 116' ' ' ASN . 0.7 OUTLIER -85.25 -11.42 54.88 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.145 0.978 . . . . 0.0 111.588 -176.801 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.07 -36.23 60.67 Favored Glycine 0 C--N 1.344 0.997 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.8 t -82.58 -2.29 53.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.321 0.648 . . . . 0.0 111.308 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.4 t -73.61 160.39 31.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.345 0.658 . . . . 0.0 110.318 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.91 2.8 3.15 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.224 0.61 . . . . 0.0 111.517 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.2 t -79.82 101.25 8.4 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.212 0.605 . . . . 0.0 110.019 178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 m -110.07 141.72 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.03 0.532 . . . . 0.0 109.795 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.494 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 96.6 mttt -106.66 101.48 10.93 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.63 107.07 13.13 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -113.88 15.31 18.6 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.153 0.981 . . . . 0.0 110.922 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.571 ' HB ' ' HE3' ' A' ' 25' ' ' LYS . 46.4 p -65.16 119.96 11.81 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.095 0.558 . . . . 0.0 111.56 -176.004 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 69.68 53.81 14.78 Favored Glycine 0 C--N 1.348 1.246 0 O-C-N 123.44 0.463 . . . . 0.0 113.508 171.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.1 t -75.8 84.69 2.77 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 123.437 0.695 . . . . 0.0 110.111 -177.295 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -82.86 148.31 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.153 0.581 . . . . 0.0 110.431 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 pt -80.16 166.81 2.36 Favored 'Isoleucine or valine' 0 C--O 1.246 0.896 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 168.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 83.6 mtp -69.43 96.85 0.92 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.155 0.503 . . . . 0.0 109.717 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.18 74.01 9.65 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.745 0.783 . . . . 0.0 109.71 -177.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.29 142.38 3.89 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.646 -1.161 . . . . 0.0 111.771 -179.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.404 ' HA ' HG23 ' A' ' 121' ' ' THR . 43.5 p90 -157.58 155.3 29.93 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.881 0.872 . . . . 0.0 110.051 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.416 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 73.3 m-85 -98.72 140.83 32.34 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.881 0.873 . . . . 0.0 108.772 174.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.423 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 37.3 mt-10 -126.35 111.09 14.1 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 170.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 21.3 tp -92.67 100.22 12.77 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.445 0.698 . . . . 0.0 109.216 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.4 t -116.34 152.61 33.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.87 0.868 . . . . 0.0 109.1 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -95.4 158.09 15.61 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 74.0 p -92.74 173.83 7.57 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.339 0.655 . . . . 0.0 110.381 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 t -69.07 -19.78 64.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.229 0.612 . . . . 0.0 109.87 170.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -87.86 9.31 22.37 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.75 0.82 . . . . 0.0 110.36 172.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 79.77 -22.07 0.3 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 125.254 1.422 . . . . 0.0 113.129 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -68.87 136.06 52.06 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.554 0.741 . . . . 0.0 111.222 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -92.38 131.07 37.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.932 0.893 . . . . 0.0 109.704 -170.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -147.17 121.63 9.7 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.598 0.759 . . . . 0.0 109.549 -173.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -93.07 141.97 27.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 27.6 m -117.45 136.09 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.366 1.066 . . . . 0.0 109.677 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -91.83 115.61 28.2 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.801 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -109.72 123.92 50.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.155 0.982 . . . . 0.0 108.673 174.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.66 170.73 4.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.91 0.484 . . . . 0.0 110.959 172.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.4 -10.13 46.91 Favored Glycine 0 N--CA 1.477 1.415 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.23 -8.34 58.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.614 1.166 . . . . 0.0 110.876 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.06 10.88 84.36 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.883 -176.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -101.85 132.36 47.67 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.13 0.972 . . . . 0.0 109.813 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.0 m -70.17 118.32 12.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 pt -99.78 -16.43 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.167 0.987 . . . . 0.0 110.964 -178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.9 tp -154.65 139.1 16.8 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 40.4 m -135.29 123.44 22.94 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.8 t -79.98 177.68 8.76 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.46 0.704 . . . . 0.0 111.755 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -72.36 166.68 22.04 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.236 0.614 . . . . 0.0 111.812 172.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.01 113.21 18.0 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 171.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.9 m-85 -93.66 138.73 31.58 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.423 0.689 . . . . 0.0 109.947 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t -74.69 -13.78 60.66 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.441 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.8 m -139.31 148.79 43.43 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.832 0.853 . . . . 0.0 110.143 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.8 tmmm? -64.63 -38.72 91.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.285 1.034 . . . . 0.0 108.678 176.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -62.85 -34.46 77.39 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.544 0.738 . . . . 0.0 111.741 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 51.0 m -64.83 -32.76 74.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.22 0.608 . . . . 0.0 111.158 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.12 -29.29 62.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.135 0.574 . . . . 0.0 111.314 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 -37.86 74.94 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.353 0.661 . . . . 0.0 110.077 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 57' ' ' LYS . 8.0 mtpm? -66.39 -35.01 79.24 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.956 171.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.97 91.66 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.586 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.485 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.7 tt -68.16 -36.45 75.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.034 0 CA-C-N 116.952 0.376 . . . . 0.0 110.368 177.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.11 -36.03 72.3 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.012 0.525 . . . . 0.0 110.736 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.0 m -73.64 -47.82 37.13 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.43 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 59' ' ' ILE . 11.1 m -66.42 -28.71 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-N 117.708 0.231 . . . . 0.0 110.854 -178.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.628 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 78.7 ttt-85 -78.22 -39.07 41.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.351 1.06 . . . . 0.0 110.684 -176.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.1 t -70.21 -35.09 73.67 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.3 175.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -97.62 4.59 50.13 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.812 0.845 . . . . 0.0 111.272 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -66.25 -46.52 61.41 Favored Pre-proline 0 CA--C 1.562 1.407 0 C-N-CA 123.904 0.882 . . . . 0.0 111.668 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.63 -18.68 32.73 Favored 'Trans proline' 0 C--N 1.393 2.914 0 C-N-CA 121.761 1.64 . . . . 0.0 112.818 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -95.72 97.23 9.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.957 0.503 . . . . 0.0 110.762 -172.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -21.61 66.71 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.209 0.603 . . . . 0.0 111.721 175.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.38 -33.65 21.35 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.783 1.633 . . . . 0.0 111.775 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -96.03 16.63 17.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.931 0.892 . . . . 0.0 112.069 -172.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -111.01 131.75 54.79 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 6.4 mm-40 -96.21 97.89 9.88 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.979 0.912 . . . . 0.0 109.196 -176.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 105.41 2.75 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.901 0.751 . . . . 0.0 109.915 179.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -136.56 160.99 37.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.498 0.719 . . . . 0.0 110.324 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.0 m -127.57 116.48 20.41 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.725 176.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.52 153.23 13.28 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 110.858 170.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -61.65 -15.26 38.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.839 0.856 . . . . 0.0 112.452 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -86.61 11.72 12.19 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.879 0.871 . . . . 0.0 111.618 178.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.28 24.84 74.54 Favored Glycine 0 C--N 1.352 1.437 0 O-C-N 123.105 0.253 . . . . 0.0 112.738 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.1 mmtp -109.4 123.12 48.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.351 0.66 . . . . 0.0 110.219 -175.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -79.68 135.38 36.53 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.495 0.718 . . . . 0.0 109.905 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -151.47 140.07 20.67 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 4.0 m-85 -109.52 133.22 53.35 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.451 HD22 HD13 ' A' ' 93' ' ' ILE . 9.6 m-20 -105.63 125.38 50.91 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.456 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.86 122.36 28.13 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -86.24 138.23 32.02 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.438 1.095 . . . . 0.0 109.644 -175.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.544 ' HB2' HG23 ' A' ' 94' ' ' ILE . . . -95.15 168.25 10.87 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.904 0.882 . . . . 0.0 110.37 175.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.15 -19.48 62.42 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.233 0.613 . . . . 0.0 111.051 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.454 ' HB3' ' HG2' ' A' ' 92' ' ' GLN . 62.1 t30 -82.72 0.85 41.56 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.891 0.877 . . . . 0.0 111.543 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 69.43 18.08 7.95 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.688 1.195 . . . . 0.0 111.62 -176.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.454 ' HG2' ' HB3' ' A' ' 90' ' ' ASN . 4.2 pt20 -100.87 -170.49 1.85 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.634 0.774 . . . . 0.0 109.236 173.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.451 HD13 HD22 ' A' ' 85' ' ' ASN . 59.3 mt -106.63 148.01 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 175.359 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.544 HG23 ' HB2' ' A' ' 88' ' ' ALA . 5.6 pt -126.83 -1.15 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.25 1.02 . . . . 0.0 111.058 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 176.78 104.2 0.18 Allowed Glycine 0 C--N 1.35 1.361 0 N-CA-C 114.118 0.407 . . . . 0.0 114.118 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 m -88.83 125.87 35.1 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 98.6 p -75.81 167.37 22.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 120.76 0.314 . . . . 0.0 111.088 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -60.94 157.31 15.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.699 0.8 . . . . 0.0 110.613 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.408 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 25.3 ptt? -78.7 119.43 21.92 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 121.17 0.509 . . . . 0.0 109.892 178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -98.47 120.11 38.32 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.97 0.908 . . . . 0.0 109.543 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.09 -35.29 71.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.992 0.517 . . . . 0.0 110.774 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 m -100.25 154.47 18.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.286 0.634 . . . . 0.0 110.413 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -84.44 -24.75 29.4 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.768 0.827 . . . . 0.0 111.851 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -79.8 -32.15 40.76 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 173.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -29.77 69.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.961 0.505 . . . . 0.0 111.698 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.8 ptt180 -65.98 -33.54 76.05 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.502 177.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -69.04 -42.44 76.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.202 0.601 . . . . 0.0 110.095 -179.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.4 m -69.64 -41.96 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.519 0.728 . . . . 0.0 111.062 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -68.71 -38.1 85.32 Favored Glycine 0 C--N 1.342 0.901 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.933 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.464 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 35.5 mm -76.77 -38.82 30.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.711 0.405 . . . . 0.0 110.206 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.44 -26.83 68.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.619 0.368 . . . . 0.0 110.757 173.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.5 t -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 92.6 t -59.28 -37.21 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.564 0.746 . . . . 0.0 110.796 175.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 110' ' ' ILE . 7.5 mtpm? -71.27 -33.1 69.47 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.545 0.738 . . . . 0.0 111.026 177.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.42 -51.71 14.17 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.626 0.771 . . . . 0.0 112.558 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -103.77 -4.15 24.02 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.819 0.847 . . . . 0.0 112.267 -173.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.74 -20.52 78.69 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.723 -0.217 . . . . 0.0 113.056 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.628 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 13.8 t -81.24 3.58 23.36 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.599 0.759 . . . . 0.0 111.596 176.507 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.0 t -89.93 169.3 11.34 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.766 0.426 . . . . 0.0 110.696 178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -123.35 11.09 9.3 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.797 0.839 . . . . 0.0 111.3 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 20' ' ' TRP . 6.2 t -74.46 80.94 1.93 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-O 121.739 0.781 . . . . 0.0 111.53 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 27.7 m -97.49 124.69 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.357 0.663 . . . . 0.0 110.499 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 3.7 mptp? -96.29 82.12 3.39 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 171.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 7.1 p-10 -72.56 96.77 2.01 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.021 0.915 . . . . 0.0 109.025 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -93.42 8.8 39.12 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.783 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 42.6 p -63.74 109.41 1.7 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.411 1.084 . . . . 0.0 110.095 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.39 26.72 35.2 Favored Glycine 0 C--N 1.343 0.935 0 CA-C-N 116.633 -0.258 . . . . 0.0 112.562 -174.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.9 t -151.83 154.78 36.86 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.226 1.01 . . . . 0.0 108.982 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.989 179.841 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 112.401 -0.279 . . . . 0.0 112.401 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.7 m -87.29 132.48 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 120.883 0.373 . . . . 0.0 110.212 176.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.5 pt -88.97 170.71 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.283 0.633 . . . . 0.0 110.508 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 61.6 mtt -110.54 109.33 19.61 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.345 0.658 . . . . 0.0 110.097 -178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.84 73.33 10.38 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 36' ' ' LYS . . . 129.89 134.59 3.75 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.462 -176.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.435 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.5 p90 -161.35 153.16 19.38 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.608 0.763 . . . . 0.0 110.786 -173.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.487 ' HB2' HG22 ' A' ' 122' ' ' VAL . 97.5 m-85 -88.51 156.74 18.92 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.463 0.705 . . . . 0.0 109.391 169.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -138.58 107.67 6.04 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 33' ' ' PHE . 37.7 tp -95.46 101.12 12.81 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.344 0.658 . . . . 0.0 109.571 -177.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.3 t -116.84 -177.74 3.27 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 123.629 0.771 . . . . 0.0 109.022 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -141.39 161.27 38.31 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -82.95 177.36 8.66 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.18 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.8 m -70.64 -22.36 62.52 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.132 0.573 . . . . 0.0 110.184 172.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.28 -5.22 48.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.841 0.856 . . . . 0.0 111.851 171.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 69.78 27.15 4.67 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.984 1.314 . . . . 0.0 111.698 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -87.15 119.66 27.61 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -88.61 142.26 27.84 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.74 0.816 . . . . 0.0 109.314 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.428 ' HD2' HD23 ' A' ' 48' ' ' LEU . 58.8 ttt180 -157.43 117.37 3.41 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 -171.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.431 ' HB3' HD13 ' A' ' 23' ' ' LEU . 46.9 p90 -98.82 133.06 43.67 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 HG23 ' A' ' 45' ' ' THR . 17.7 m -107.78 130.76 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.687 0.795 . . . . 0.0 109.05 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.4 tp -100.67 117.57 35.06 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 97.6 mttt -120.37 142.01 49.56 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.591 1.157 . . . . 0.0 109.516 -176.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.34 -175.92 0.87 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.067 0.947 . . . . 0.0 111.677 173.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.98 -21.76 63.94 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 -176.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -84.34 -4.3 58.79 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.644 0.777 . . . . 0.0 112.533 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.84 8.4 87.71 Favored Glycine 0 C--N 1.343 0.943 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -82.42 132.15 35.21 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.729 0.812 . . . . 0.0 109.423 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.3 m -64.97 123.76 20.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.358 0.663 . . . . 0.0 112.007 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.484 HD11 ' HG ' ' A' ' 35' ' ' LEU . 29.9 pt -105.85 -14.45 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.141 0.976 . . . . 0.0 110.401 172.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 11.6 tp -165.59 144.49 6.26 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.795 0.838 . . . . 0.0 109.002 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.465 HG23 HG12 ' A' ' 34' ' ' VAL . 26.9 m -152.19 114.01 4.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.956 0.903 . . . . 0.0 109.221 176.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.3 m -64.26 170.17 3.99 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.212 1.005 . . . . 0.0 112.014 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.65 174.63 11.39 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.888 0.375 . . . . 0.0 110.21 175.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.428 HD23 ' HD2' ' A' ' 32' ' ' ARG . 66.6 mt -71.71 113.66 8.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.183 0.593 . . . . 0.0 109.748 177.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -90.02 137.4 32.37 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.393 0.677 . . . . 0.0 109.998 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.9 t -69.16 -21.49 63.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.225 0.61 . . . . 0.0 111.624 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p -149.68 156.7 42.32 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.777 0.831 . . . . 0.0 110.371 -174.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -66.94 -28.82 68.6 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 177.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.9 p -59.0 -39.86 83.1 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 123.982 0.801 . . . . 0.0 110.79 176.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.9 m -71.85 -30.05 65.04 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.715 0.806 . . . . 0.0 111.383 177.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.67 -39.06 64.7 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.216 0.606 . . . . 0.0 110.986 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.73 -34.96 72.43 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.881 0.872 . . . . 0.0 110.058 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -62.07 -44.0 97.62 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.367 1.067 . . . . 0.0 109.74 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.84 -49.37 78.67 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.227 0.955 . . . . 0.0 113.042 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.568 ' HA ' HG22 ' A' ' 62' ' ' VAL . 14.9 tt -72.78 -33.83 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 122.297 0.239 . . . . 0.0 111.364 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.8 -32.07 73.39 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.901 0.48 . . . . 0.0 110.934 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.5 m -75.92 -45.45 35.1 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.509 176.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' A' ' 59' ' ' ILE . 24.1 m -66.66 -36.62 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 118.005 0.366 . . . . 0.0 111.185 -175.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.09 73.53 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.337 0.589 . . . . 0.0 110.142 -177.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.6 t -77.33 -32.7 55.39 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.973 0.909 . . . . 0.0 110.372 177.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -99.57 10.7 40.88 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.698 0.799 . . . . 0.0 111.385 -178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.566 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.6 m -58.76 -46.82 99.54 Favored Pre-proline 0 N--CA 1.484 1.251 0 C-N-CA 123.391 0.676 . . . . 0.0 112.618 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.18 -13.07 15.63 Favored 'Trans proline' 0 C--N 1.391 2.782 0 C-N-CA 121.559 1.506 . . . . 0.0 113.124 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -82.71 77.64 9.43 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -178.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 0.4 OUTLIER -64.45 -20.66 66.31 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.979 -177.861 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -67.05 -37.89 84.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.767 0.827 . . . . 0.0 110.923 174.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -71.01 -23.61 62.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.273 0.629 . . . . 0.0 111.679 178.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.413 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 67.8 m-85 -71.63 115.33 10.69 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 164.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.23 117.76 32.16 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.097 0.959 . . . . 0.0 108.865 -173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HD2' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.72 105.36 4.99 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 110.633 -174.283 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -100.18 115.32 29.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.325 1.05 . . . . 0.0 109.52 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.0 m -112.75 111.44 22.23 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB3' ' HB2' ' A' ' 81' ' ' LYS . . . -69.37 153.04 44.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.393 173.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 p -61.82 -21.29 64.5 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.826 0.85 . . . . 0.0 111.573 175.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -84.03 11.51 7.8 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.821 0.848 . . . . 0.0 111.493 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.48 17.25 77.71 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 113.236 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 75.5 mmtt -84.25 123.12 29.8 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -102.8 124.14 47.77 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.464 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 8.1 p90 -152.81 177.94 10.18 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.955 1.302 . . . . 0.0 108.467 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.56 157.41 44.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.507 0.323 . . . . 0.0 111.329 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p30 -135.61 129.97 33.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.112 0.565 . . . . 0.0 110.183 168.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.777 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -81.07 115.23 20.41 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -94.11 137.59 33.13 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.805 0.842 . . . . 0.0 109.794 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -93.95 175.85 6.56 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.004 0.922 . . . . 0.0 110.74 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.73 -23.41 66.74 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.77 0.828 . . . . 0.0 111.474 175.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -84.57 5.24 28.53 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.216 1.007 . . . . 0.0 111.566 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 66.95 10.46 7.67 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.087 1.355 . . . . 0.0 112.238 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.17 148.64 23.54 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.094 0.557 . . . . 0.0 110.558 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.528 HG21 ' HB2' ' A' ' 96' ' ' SER . 54.9 mt -78.22 99.99 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 170.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.777 HD11 HD22 ' A' ' 86' ' ' LEU . 14.3 pt -81.26 -6.75 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.222 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -179.58 121.31 0.73 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-O 119.345 -0.697 . . . . 0.0 111.812 173.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.528 ' HB2' HG21 ' A' ' 93' ' ' ILE . 23.1 t -119.31 113.71 21.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.858 0.863 . . . . 0.0 110.468 177.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.5 t -65.29 161.14 20.11 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.762 0.825 . . . . 0.0 111.372 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -88.95 163.46 15.56 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.296 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.554 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 17.6 ptt? -73.14 120.68 19.09 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.388 0.675 . . . . 0.0 111.668 -173.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -101.11 157.12 17.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.208 173.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.46 -46.0 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.837 0.455 . . . . 0.0 111.277 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.5 p -101.45 153.74 19.43 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 123.27 0.628 . . . . 0.0 110.88 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.41 82.44 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.888 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -59.56 -29.94 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.417 0.687 . . . . 0.0 112.763 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.2 m -71.56 -40.48 69.95 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 112.073 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.447 ' O ' HG12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -76.21 -26.83 56.51 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.395 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -65.89 -43.13 89.14 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 122.983 0.513 . . . . 0.0 110.138 172.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.7 m -63.6 -33.9 76.63 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.897 171.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.34 -40.0 98.44 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.944 0.777 . . . . 0.0 113.247 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 106' ' ' ARG . 44.5 mm -60.04 -46.22 94.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-O 121.213 0.53 . . . . 0.0 109.741 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.92 78.9 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.52 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.4 t -71.8 -43.27 65.95 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.147 0.579 . . . . 0.0 110.455 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.3 t -73.56 -24.72 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.43 0.692 . . . . 0.0 110.56 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.566 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.7 OUTLIER -62.47 -45.88 91.04 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 172.682 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.41 -50.15 16.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.998 -175.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -84.17 -26.9 28.45 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.154 0.982 . . . . 0.0 111.178 -172.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.446 ' HA2' ' HZ ' ' A' ' 21' ' ' PHE . . . -65.41 -43.2 95.31 Favored Glycine 0 C--N 1.346 1.114 0 O-C-N 123.613 0.571 . . . . 0.0 112.797 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 46.6 p -68.56 -27.7 66.31 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.586 0.754 . . . . 0.0 111.76 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -75.28 121.81 22.75 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.425 0.69 . . . . 0.0 110.15 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.04 43.34 1.14 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.368 1.067 . . . . 0.0 111.159 -174.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.435 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.6 t -95.36 111.93 23.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.108 0.963 . . . . 0.0 108.847 176.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 21' ' ' PHE . 27.0 t -134.73 135.33 53.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.245 0.618 . . . . 0.0 110.044 -174.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -91.38 95.31 9.92 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 166.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -75.12 95.03 3.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.689 0.757 . . . . 0.0 109.292 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -107.31 27.35 9.17 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.581 -1.191 . . . . 0.0 110.393 -178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 45.3 p -70.63 87.46 0.67 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.669 0.788 . . . . 0.0 110.814 -177.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.3 -2.9 79.13 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.153 -0.931 . . . . 0.0 113.491 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 50.6 m -77.96 97.88 5.48 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.157 0.583 . . . . 0.0 109.916 177.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 . . . . . 0 C--O 1.245 0.837 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.409 0 N-CA-C 112.216 -0.354 . . . . 0.0 112.216 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.6 m -78.84 140.67 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.508 0.723 . . . . 0.0 110.343 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 pp -82.44 130.16 36.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 122.792 0.437 . . . . 0.0 109.869 176.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 91.7 mmm -90.24 110.85 21.88 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.42 73.79 8.45 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.57 139.25 2.65 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.033 -176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -146.1 157.38 43.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.167 0.987 . . . . 0.0 109.581 -177.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -99.5 151.31 21.28 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.468 0.707 . . . . 0.0 110.015 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 48.3 mt-10 -137.29 115.05 11.33 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.431 1.092 . . . . 0.0 108.5 171.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.6 tp -80.45 98.41 7.52 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.3 p -94.09 155.06 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.343 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 29' ' ' ASN . 12.5 ptmm? -113.65 165.81 12.16 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.495 0.718 . . . . 0.0 109.285 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -102.27 -178.94 3.84 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.055 0.542 . . . . 0.0 109.955 174.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.4 t -65.9 -27.21 68.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.032 0.533 . . . . 0.0 110.351 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.24 2.87 22.75 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.78 0.832 . . . . 0.0 111.728 174.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.432 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 12.3 t30 70.35 9.64 7.03 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.876 1.27 . . . . 0.0 111.477 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -74.63 131.48 40.95 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.153 0.581 . . . . 0.0 109.997 -177.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -92.58 137.63 32.2 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.03 0.932 . . . . 0.0 110.384 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -155.65 141.6 18.18 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -103.24 136.82 42.3 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 HG23 ' A' ' 45' ' ' THR . 27.7 m -107.36 132.82 53.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 175.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.7 tp -100.22 114.98 28.82 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 171.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.54 141.61 35.71 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.395 1.078 . . . . 0.0 108.897 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.27 175.46 10.63 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.038 0.535 . . . . 0.0 110.201 171.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.94 -7.45 56.09 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 113.914 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -73.17 -18.37 61.28 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.001 0.92 . . . . 0.0 111.053 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.61 -7.51 74.47 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.413 -173.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -88.48 136.91 32.76 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.095 0.958 . . . . 0.0 110.176 -177.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.7 m -75.78 121.41 22.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.014 0.526 . . . . 0.0 109.786 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.39 -25.14 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.898 0.879 . . . . 0.0 110.839 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.0 tp -148.01 143.6 27.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.218 0.607 . . . . 0.0 109.963 -171.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.405 HG23 HG12 ' A' ' 34' ' ' VAL . 87.8 m -149.81 129.93 13.58 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.197 0.999 . . . . 0.0 108.806 175.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.4 p -78.6 170.85 16.0 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.134 0.573 . . . . 0.0 111.024 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 93' ' ' ILE . 7.9 pt-20 -70.17 170.15 12.17 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.078 0.551 . . . . 0.0 111.049 175.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.25 112.12 13.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -92.79 142.06 27.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.061 0.945 . . . . 0.0 109.761 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.7 p -72.51 -25.93 61.58 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.295 0.638 . . . . 0.0 111.022 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.5 m -124.42 138.43 54.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.926 0.89 . . . . 0.0 110.153 -175.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -67.47 -28.12 67.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.858 0.463 . . . . 0.0 110.475 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.5 p -57.67 -40.77 80.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.161 0.984 . . . . 0.0 110.985 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -65.93 -35.14 79.78 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.917 0.887 . . . . 0.0 111.127 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.3 -33.15 61.17 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.44 0.696 . . . . 0.0 111.411 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -69.86 -43.54 71.66 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.631 0.773 . . . . 0.0 110.195 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.13 -22.45 52.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.58 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.18 75.69 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.708 0.63 . . . . 0.0 112.622 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' HG22 ' A' ' 62' ' ' VAL . 6.1 tt -67.48 -33.07 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 122.699 0.4 . . . . 0.0 110.795 176.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.81 82.32 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.107 0.479 . . . . 0.0 110.346 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -76.09 -39.64 54.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.355 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 59' ' ' ILE . 19.9 m -64.59 -33.11 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 CA-C-N 119.204 0.911 . . . . 0.0 110.495 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -70.6 -39.4 73.81 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 124.265 0.978 . . . . 0.0 110.624 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.8 t -74.14 -30.72 62.43 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.539 0.736 . . . . 0.0 110.841 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -107.55 18.35 21.59 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.786 0.835 . . . . 0.0 111.256 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.63 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 55.5 m -59.81 -49.63 90.66 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 123.398 0.679 . . . . 0.0 111.762 168.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.66 -4.65 12.97 Favored 'Trans proline' 0 C--N 1.398 3.165 0 C-N-CA 121.968 1.779 . . . . 0.0 113.098 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -92.67 81.7 4.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.965 0.506 . . . . 0.0 110.126 -173.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.55 -29.99 59.97 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 124.52 1.128 . . . . 0.0 112.265 176.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -63.26 -35.39 80.2 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.164 1.386 . . . . 0.0 110.514 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -76.14 -23.11 54.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.609 0.764 . . . . 0.0 112.117 -176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -73.91 138.63 44.4 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 73.3 mm-40 -98.97 95.34 7.08 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.7 103.68 15.38 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 56.7 mttm -124.5 157.3 35.62 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 109.348 -175.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.5 m -127.23 115.54 19.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.644 0.778 . . . . 0.0 109.563 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.23 159.7 5.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.162 0.985 . . . . 0.0 111.83 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.6 p -57.69 -27.0 62.51 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.328 1.051 . . . . 0.0 112.806 -174.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -88.83 16.53 6.71 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 112.109 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.77 31.83 62.03 Favored Glycine 0 C--N 1.35 1.339 0 CA-C-N 116.372 -0.376 . . . . 0.0 113.335 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.7 mmtt -101.41 122.1 43.14 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.082 0.553 . . . . 0.0 109.848 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -95.2 130.86 41.76 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.484 0.714 . . . . 0.0 109.491 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.448 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 45.6 p90 -149.37 161.44 42.06 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.302 0.641 . . . . 0.0 109.616 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 42.2 p90 -130.91 135.9 48.1 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.206 0.602 . . . . 0.0 109.865 176.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -112.64 117.21 31.65 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 172.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 94' ' ' ILE . 0.8 OUTLIER -76.68 109.38 10.4 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.337 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -90.22 137.67 32.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.857 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -100.01 154.69 18.19 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.522 0.729 . . . . 0.0 109.19 169.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.03 -16.44 61.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -74.8 1.85 11.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.474 1.11 . . . . 0.0 111.993 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.0 m170 68.6 14.71 9.08 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.238 1.415 . . . . 0.0 111.428 -177.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -103.86 140.86 37.09 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.308 0.643 . . . . 0.0 109.632 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 47' ' ' GLU . 51.2 mm -80.13 98.39 3.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.996 0.919 . . . . 0.0 108.877 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 86' ' ' LEU . 24.7 pt -81.99 -12.9 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.511 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.69 142.17 8.51 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 t -153.55 165.29 36.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.645 0.778 . . . . 0.0 109.63 175.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 t -143.7 148.76 36.2 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.2 pp0? -68.93 -42.61 76.54 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.715 0.635 . . . . 0.0 110.483 -175.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.469 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 27.7 ptt? 176.24 155.08 0.21 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.425 1.49 . . . . 0.0 108.632 171.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -103.59 128.68 50.82 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 165.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.58 98.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.914 0.886 . . . . 0.0 111.587 -173.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 p -111.81 146.59 37.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.097 0.959 . . . . 0.0 110.425 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -75.33 -16.66 60.39 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.637 0.775 . . . . 0.0 111.797 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.66 -33.37 62.49 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.399 0.68 . . . . 0.0 110.384 173.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.1 t -67.88 -20.08 65.09 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 17.2 ptt180 -55.99 -37.85 69.67 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 122.915 0.486 . . . . 0.0 110.97 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.18 -39.31 71.93 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.339 1.056 . . . . 0.0 110.127 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.82 -40.12 96.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.142 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.73 -47.04 70.05 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.888 -178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 43.1 mm -59.38 -45.16 93.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 122.785 0.434 . . . . 0.0 109.963 176.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.35 86.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.579 0.751 . . . . 0.0 111.423 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.2 t -76.05 -38.27 57.33 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.163 0.585 . . . . 0.0 111.058 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.32 -34.58 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.384 0.673 . . . . 0.0 110.538 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.9 OUTLIER -69.17 -48.66 61.62 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.48 0.712 . . . . 0.0 109.963 178.551 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 118' ' ' THR . . . -70.26 -51.28 31.81 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.142 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -83.53 0.21 47.51 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.453 0.701 . . . . 0.0 111.96 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.94 -30.97 72.23 Favored Glycine 0 C--N 1.347 1.147 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 115' ' ' ALA . 11.5 t -85.23 0.78 50.78 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.786 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.1 m -67.15 108.87 2.83 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 122.905 0.482 . . . . 0.0 110.214 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -73.33 -14.61 61.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.746 0.418 . . . . 0.0 111.462 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.4 t -66.04 103.55 0.97 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.571 0.748 . . . . 0.0 110.282 176.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.51 122.37 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 123.867 0.867 . . . . 0.0 110.064 177.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.45 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 22.1 mtpp -83.05 148.36 27.59 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.078 173.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -106.24 94.83 5.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -81.89 -10.98 59.13 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.841 0.856 . . . . 0.0 111.152 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.412 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 37.8 p -63.51 89.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.363 1.065 . . . . 0.0 112.261 -174.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.38 39.0 32.08 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.72 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.0 t -151.38 151.38 31.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.245 0.618 . . . . 0.0 110.252 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 7.1 t30 . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.085 0.954 . . . . 0.0 109.316 -179.55 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.738 0 N-CA-C 113.265 0.066 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.1 p90 -160.03 150.13 18.39 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.195 0.522 . . . . 0.0 111.027 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -94.32 149.35 21.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.178 0.991 . . . . 0.0 108.598 170.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.6 mt-10 -131.37 109.5 10.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 171.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.5 tp -87.16 107.98 18.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.5 t -122.62 142.96 50.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.935 0.894 . . . . 0.0 109.045 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -94.7 139.65 30.95 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 171.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.0 m -76.38 -175.54 3.29 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 0.0 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.6 t -61.16 -25.78 67.25 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.062 0.545 . . . . 0.0 111.181 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -95.63 16.16 18.01 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.053 0.941 . . . . 0.0 110.787 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 64.06 17.62 10.73 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.261 1.424 . . . . 0.0 112.992 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 86.5 mm-40 -82.5 127.49 33.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.529 0.731 . . . . 0.0 110.724 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -85.89 122.11 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.836 0.854 . . . . 0.0 109.076 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -147.39 120.39 8.79 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 124.171 0.989 . . . . 0.0 108.556 -172.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -99.18 137.9 37.04 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.3 m -107.53 131.72 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.6 tp -91.36 123.49 34.82 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -115.7 149.76 37.89 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 109.172 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.54 -173.75 4.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.313 1.045 . . . . 0.0 110.275 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -57.34 -34.6 68.38 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 114.509 0.564 . . . . 0.0 114.509 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -88.66 8.1 30.26 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.623 0.769 . . . . 0.0 112.005 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 6.43 89.3 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.797 -0.183 . . . . 0.0 113.302 -176.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.85 110.06 4.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 110.424 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -65.08 121.37 14.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 pt -114.38 -20.78 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.61 1.164 . . . . 0.0 110.897 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -147.81 146.52 29.17 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.9 m -145.78 118.12 8.44 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.745 0.818 . . . . 0.0 108.936 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 98.1 p -69.21 170.19 10.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.748 0.419 . . . . 0.0 110.871 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.84 175.15 10.32 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 121.358 0.599 . . . . 0.0 110.895 174.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 89.0 mt -75.67 113.03 12.65 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.86 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.533 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 66.6 m-85 -100.97 133.61 45.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.685 0.794 . . . . 0.0 109.319 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.3 m -68.34 -25.56 65.16 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.155 0.582 . . . . 0.0 111.059 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -130.05 147.09 51.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.474 0.71 . . . . 0.0 110.981 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -27.8 68.77 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.781 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.8 p -57.63 -36.69 72.15 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.815 0.846 . . . . 0.0 111.782 175.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.533 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 13.2 m -69.8 -33.03 71.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.605 0.762 . . . . 0.0 110.752 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.67 59.89 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.531 0.732 . . . . 0.0 111.503 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -69.39 -45.26 69.72 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.288 0.635 . . . . 0.0 109.759 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -71.29 -24.72 62.2 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.81 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -64.14 -51.13 55.64 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.543 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.8 tt -71.39 -34.29 53.06 Favored 'Isoleucine or valine' 0 C--N 1.357 0.911 0 CA-C-N 116.641 0.221 . . . . 0.0 111.02 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.72 86.25 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.245 0.545 . . . . 0.0 110.275 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.6 m -74.17 -43.67 56.41 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.365 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 59' ' ' ILE . 13.2 m -65.05 -29.23 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-N 119.046 0.839 . . . . 0.0 111.036 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -76.02 -35.44 59.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.041 0.536 . . . . 0.0 110.277 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -77.83 -31.77 51.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.462 0.705 . . . . 0.0 110.844 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -101.92 12.13 37.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.752 0.821 . . . . 0.0 110.9 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.9 t -64.35 -48.93 74.68 Favored Pre-proline 0 CA--C 1.559 1.325 0 C-N-CA 123.919 0.888 . . . . 0.0 111.285 174.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -78.99 -9.52 15.47 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 121.744 1.629 . . . . 0.0 112.733 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -84.92 81.22 8.99 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -59.68 -28.09 66.98 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.377 1.071 . . . . 0.0 112.256 -177.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -78.54 -23.88 45.97 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NE ' ' HB2' ' A' ' 87' ' ' LYS . 6.5 tpm_? -75.5 -21.9 57.62 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 111.435 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -70.48 133.51 46.88 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 169.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 43.5 mm-40 -96.18 97.11 9.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -78.31 103.63 8.38 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -122.4 159.49 27.44 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.872 1.269 . . . . 0.0 110.056 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.5 m -128.26 115.94 19.09 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.443 0.697 . . . . 0.0 109.732 174.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.18 156.47 31.66 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.802 0.841 . . . . 0.0 111.342 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.4 m -67.08 -10.8 53.82 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 124.028 0.931 . . . . 0.0 111.811 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.86 4.9 17.66 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 123.902 0.881 . . . . 0.0 110.083 172.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 34.13 67.87 Favored Glycine 0 C--N 1.352 1.434 0 C-N-CA 123.206 0.432 . . . . 0.0 112.731 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.6 mmtt -114.32 124.52 52.2 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.188 0.595 . . . . 0.0 110.211 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.49 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 77.4 m-85 -91.78 125.79 36.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.308 0.643 . . . . 0.0 109.876 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.635 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 25.3 p90 -146.66 174.75 11.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.244 1.018 . . . . 0.0 108.921 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.498 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 44.9 p90 -145.0 135.49 24.29 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.786 0.326 . . . . 0.0 111.345 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.54 ' HB3' HD12 ' A' ' 93' ' ' ILE . 6.1 m-20 -112.48 114.88 27.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.589 0.756 . . . . 0.0 109.328 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 41.5 tp -80.23 119.06 22.48 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.442 ' HB2' ' NE ' ' A' ' 71' ' ' ARG . 34.0 mmtp -87.11 156.85 19.55 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.009 0.924 . . . . 0.0 111.27 -177.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.6 175.14 5.6 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.227 167.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.39 -28.25 69.86 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.525 0.678 . . . . 0.0 110.63 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -81.91 10.81 5.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.456 1.103 . . . . 0.0 112.153 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 66.59 4.89 3.54 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.78 1.232 . . . . 0.0 111.983 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -85.38 140.83 30.45 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.771 0.828 . . . . 0.0 110.427 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.54 HD12 ' HB3' ' A' ' 85' ' ' ASN . 20.5 mm -76.14 99.67 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 14.2 pt -79.44 -11.37 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.019 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.38 108.2 0.26 Allowed Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.3 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.423 ' HB3' HG21 ' A' ' 93' ' ' ILE . 77.8 p -92.01 134.54 34.72 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -88.39 160.32 17.63 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.169 0.509 . . . . 0.0 109.855 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.82 141.42 48.01 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.865 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.635 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.1 ptt? -73.47 116.51 14.13 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.413 0.625 . . . . 0.0 109.645 -176.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -93.35 158.32 15.8 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.252 -176.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 -54.68 7.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 122.567 0.347 . . . . 0.0 110.453 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 p -97.36 155.85 16.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.371 0.668 . . . . 0.0 111.782 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -70.49 -33.54 71.34 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.641 0.777 . . . . 0.0 110.895 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -63.08 -32.19 73.51 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.004 0.522 . . . . 0.0 111.292 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -71.48 -30.1 65.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.432 0.693 . . . . 0.0 110.662 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.49 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 57.5 ttp180 -69.77 -38.73 76.85 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.319 0.648 . . . . 0.0 109.949 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 22.3 mm-40 -71.14 -40.08 71.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.244 0.618 . . . . 0.0 110.986 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.4 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.466 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.94 -44.63 97.56 Favored Glycine 0 C--N 1.347 1.18 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.471 174.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.93 -46.44 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.435 0.694 . . . . 0.0 109.961 176.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.48 80.23 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.923 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.5 t -76.0 -44.15 40.89 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.993 0.517 . . . . 0.0 110.451 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 87.5 t -68.57 -27.78 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.004 0.522 . . . . 0.0 110.229 177.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -69.89 -37.83 76.16 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.002 0.521 . . . . 0.0 110.706 173.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.22 -51.06 16.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.448 0.699 . . . . 0.0 111.74 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -89.28 -13.95 36.92 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 111.14 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.81 -20.71 70.23 Favored Glycine 0 C--N 1.349 1.255 0 CA-C-N 116.473 -0.33 . . . . 0.0 113.164 178.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.6 p -72.19 -10.87 60.36 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.915 0.486 . . . . 0.0 111.263 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.7 t -84.02 172.91 11.59 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.681 0.792 . . . . 0.0 110.179 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -148.29 24.94 1.01 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.782 0.833 . . . . 0.0 109.064 175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -73.94 83.0 1.71 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.589 0.756 . . . . 0.0 110.794 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 47.1 t -89.53 120.63 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.722 0.809 . . . . 0.0 110.617 -176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 68.3 mttm -93.04 113.54 25.83 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.392 1.077 . . . . 0.0 108.708 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.13 96.1 2.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.766 0.794 . . . . 0.0 109.938 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -92.27 -7.77 47.14 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.849 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.478 0.957 0 C-N-CA 124.373 1.069 . . . . 0.0 111.178 172.451 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.317 0 CA-C-O 120.933 0.185 . . . . 0.0 113.176 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -140.1 158.38 44.15 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.877 1.271 . . . . 0.0 109.526 -176.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.451 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 66.2 m-85 -98.85 146.94 25.43 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.636 0.775 . . . . 0.0 109.43 173.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -133.55 111.57 10.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.619 0.768 . . . . 0.0 109.122 174.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -80.3 95.94 6.49 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 173.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -104.27 -177.38 3.35 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.003 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 29' ' ' ASN . 22.0 ptmt -135.01 146.45 49.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.136 0.574 . . . . 0.0 109.657 174.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.4 m -78.12 169.72 17.8 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.54 0.736 . . . . 0.0 110.344 170.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.52 -10.98 59.12 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.101 0.56 . . . . 0.0 111.177 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -86.87 8.58 22.36 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.059 0.943 . . . . 0.0 111.569 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.504 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 42.3 m-80 69.46 7.94 6.5 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.482 1.513 . . . . 0.0 112.88 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HB2' HD12 ' A' ' 48' ' ' LEU . 11.6 mm-40 -84.74 137.59 33.12 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.001 0.52 . . . . 0.0 110.086 -178.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -91.72 134.05 35.06 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.978 0.911 . . . . 0.0 109.854 -172.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -152.87 141.26 20.65 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.625 0.77 . . . . 0.0 108.967 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -98.59 141.06 31.91 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 28.8 m -113.04 133.37 59.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 172.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.5 OUTLIER -88.0 108.04 19.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 167.645 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 4.3 ttmp? -111.54 114.86 28.22 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.155 0.982 . . . . 0.0 109.657 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.42 173.21 2.17 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.173 0.989 . . . . 0.0 112.602 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.15 -15.91 61.47 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.511 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -74.83 -6.06 46.95 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.059 0.944 . . . . 0.0 111.671 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.74 14.94 80.34 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -117.36 137.45 52.45 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.049 0.94 . . . . 0.0 109.97 -177.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 60.8 m -76.82 121.64 23.66 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.364 0.666 . . . . 0.0 110.401 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.5 pt -89.49 -19.84 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.008 0.923 . . . . 0.0 110.843 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 tp -159.89 118.37 2.73 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -172.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 55.4 m -111.31 127.35 55.61 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.457 0.703 . . . . 0.0 109.377 175.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.9 t -81.56 170.2 16.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.603 0.361 . . . . 0.0 111.13 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -83.22 -175.77 5.99 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.476 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.5 mm? -85.5 113.62 21.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.753 -172.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.435 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 75.8 m-85 -107.26 119.58 39.8 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.825 0.85 . . . . 0.0 108.721 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 81.4 p -61.71 -33.48 74.1 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.561 0.744 . . . . 0.0 111.644 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -113.75 135.8 53.55 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.095 0.958 . . . . 0.0 109.092 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.32 -28.15 67.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.452 0.701 . . . . 0.0 111.126 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.8 p -57.39 -36.21 70.98 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.074 0.95 . . . . 0.0 111.698 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 24.9 m -71.45 -28.85 64.25 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.252 0.621 . . . . 0.0 111.407 177.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.56 -32.11 57.96 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.608 0.763 . . . . 0.0 111.29 173.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -73.4 -34.07 65.32 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.597 0.759 . . . . 0.0 110.577 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -78.09 -26.34 48.06 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.701 170.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.39 -41.91 94.19 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.361 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.495 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -71.99 -32.41 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 175.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.22 -32.91 74.42 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.752 0.421 . . . . 0.0 110.738 172.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.2 m -69.3 -53.74 18.18 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.381 176.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.495 HG22 ' HA ' ' A' ' 59' ' ' ILE . 16.4 m -63.9 -29.1 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 123.047 0.217 . . . . 0.0 111.269 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -55.85 17.6 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.827 0.851 . . . . 0.0 108.728 178.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.9 t -66.52 -23.6 66.26 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.333 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.19 4.7 46.84 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.962 0.905 . . . . 0.0 112.28 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.1 m -66.76 -48.12 53.51 Favored Pre-proline 0 CA--C 1.565 1.531 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.254 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.95 -16.1 23.23 Favored 'Trans proline' 0 C--N 1.398 3.134 0 C-N-CA 121.814 1.676 . . . . 0.0 112.728 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -84.63 99.84 11.05 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.211 0.604 . . . . 0.0 110.394 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.67 -23.42 65.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.929 0.891 . . . . 0.0 112.535 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -73.3 -30.18 63.21 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.149 0.979 . . . . 0.0 110.615 -176.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -75.97 -12.04 60.07 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.41 0.684 . . . . 0.0 112.055 -171.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -129.17 145.77 51.24 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.579 0.351 . . . . 0.0 110.282 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.424 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 36.8 tt0 -130.7 147.24 52.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.531 0.732 . . . . 0.0 109.875 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.06 112.57 5.76 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 74.7 mmtt -111.9 142.04 44.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.666 0.787 . . . . 0.0 111.459 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 55.4 m -123.55 117.63 25.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.452 0.701 . . . . 0.0 109.352 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.04 168.4 6.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.375 1.07 . . . . 0.0 112.232 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.3 m -64.56 -24.45 67.6 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.223 1.009 . . . . 0.0 112.079 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.47 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 14.7 m120 -89.21 9.78 24.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 0.0 111.337 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.0 5.43 89.74 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 116.499 -0.318 . . . . 0.0 113.326 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 73.2 mmtt -73.36 152.56 40.82 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.473 0.709 . . . . 0.0 110.311 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 92.7 m-85 -113.27 126.73 55.73 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.303 0.641 . . . . 0.0 109.989 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.83 -179.92 8.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.066 1.346 . . . . 0.0 108.295 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -139.38 172.26 13.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.989 -0.444 . . . . 0.0 109.948 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -145.31 141.9 28.96 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.669 0.388 . . . . 0.0 110.489 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.59 140.11 31.69 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.929 0.892 . . . . 0.0 109.214 177.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -121.78 158.83 27.96 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.66 1.584 . . . . 0.0 110.247 -172.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -128.63 -176.48 3.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.831 0.852 . . . . 0.0 110.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.44 -22.02 66.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.721 0.808 . . . . 0.0 111.625 175.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -73.24 -16.72 61.4 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.522 1.129 . . . . 0.0 111.315 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 m80 67.15 14.68 9.86 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.324 1.45 . . . . 0.0 111.025 -167.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -88.36 161.76 16.93 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.493 0.717 . . . . 0.0 110.269 177.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.3 mm -84.66 104.08 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.948 -1.023 . . . . 0.0 108.352 174.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.84 -2.33 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.005 0.522 . . . . 0.0 110.471 173.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.59 146.49 8.88 Favored Glycine 0 C--N 1.341 0.851 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.3 p -156.61 123.48 5.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.173 0.989 . . . . 0.0 108.761 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.9 m -72.43 171.89 11.44 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.315 1.046 . . . . 0.0 112.649 -171.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.41 150.7 38.26 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 171.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.62 115.27 12.83 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -100.66 150.34 22.84 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.65 -31.91 52.94 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.388 0.275 . . . . 0.0 110.971 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.3 p -110.81 148.7 31.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.065 0.546 . . . . 0.0 111.778 -174.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.32 -24.4 61.3 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.421 1.089 . . . . 0.0 112.353 -175.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -68.78 -32.91 72.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.276 0.631 . . . . 0.0 111.54 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.5 m -68.76 -31.38 70.37 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.015 0.526 . . . . 0.0 112.368 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.413 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 38.6 ptt180 -75.99 -39.75 55.19 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 117.421 0.101 . . . . 0.0 110.875 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -76.91 -28.64 55.39 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -66.41 -38.4 87.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 168.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.35 -37.06 92.49 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.748 174.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.9 mm -59.39 -51.44 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.546 0.739 . . . . 0.0 109.572 174.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.79 68.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.671 0.789 . . . . 0.0 111.353 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.3 t -75.52 -33.81 60.75 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.897 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.1 t -70.45 -35.05 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 122.971 0.508 . . . . 0.0 110.235 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -67.53 -34.27 76.74 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.564 0.746 . . . . 0.0 111.053 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -50.17 8.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.167 0.587 . . . . 0.0 111.294 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -89.22 -1.77 58.21 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.695 0.798 . . . . 0.0 112.208 -170.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.07 -25.12 76.3 Favored Glycine 0 C--N 1.339 0.721 0 CA-C-O 120.144 -0.254 . . . . 0.0 112.747 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.3 t -89.28 -5.96 57.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.481 0.712 . . . . 0.0 111.38 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.0 m -66.03 143.21 57.5 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.956 0.502 . . . . 0.0 110.684 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -111.65 8.21 20.73 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.624 0.769 . . . . 0.0 110.742 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 23.4 m -77.38 91.62 3.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.866 0.867 . . . . 0.0 110.792 -175.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.6 t -104.24 113.05 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.609 0.764 . . . . 0.0 109.827 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 43.8 mtpt -101.38 110.27 22.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.583 0.753 . . . . 0.0 109.905 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -76.82 94.45 3.88 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-O 122.149 0.976 . . . . 0.0 110.094 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -95.25 7.79 45.08 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 110.707 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 CA--C 1.553 1.065 0 C-N-CA 123.715 0.806 . . . . 0.0 111.344 177.629 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.607 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -159.72 153.79 23.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.469 0.708 . . . . 0.0 110.276 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -100.03 152.09 20.62 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.932 173.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -133.08 114.66 14.17 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.872 0.869 . . . . 0.0 109.18 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 52' ' ' LYS . 40.8 tp -80.5 98.32 7.52 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -102.45 179.5 4.28 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.448 1.099 . . . . 0.0 109.306 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -146.48 145.07 30.06 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 168.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.3 m -81.45 -173.35 4.32 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.279 0.632 . . . . 0.0 111.422 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -63.06 -22.6 66.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.799 0.84 . . . . 0.0 111.115 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.26 -16.74 61.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.501 1.12 . . . . 0.0 111.95 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 71.58 11.27 6.49 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.543 1.537 . . . . 0.0 111.795 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -81.14 138.09 35.91 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.526 0.73 . . . . 0.0 109.102 174.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -89.57 138.36 31.53 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 110.33 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -149.5 130.89 14.71 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.118 0.967 . . . . 0.0 108.99 -168.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -90.77 143.49 26.68 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.77 131.64 71.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 166.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.26 110.18 22.41 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -98.39 123.51 42.56 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 171.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.4 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.96 178.87 0.75 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.578 0.751 . . . . 0.0 111.478 176.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.91 -20.83 54.35 Favored Glycine 0 CA--C 1.54 1.65 0 CA-C-O 121.105 0.28 . . . . 0.0 112.652 172.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.82 -23.29 65.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.367 1.467 . . . . 0.0 111.993 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.16 -3.86 82.58 Favored Glycine 0 C--N 1.35 1.31 0 C-N-CA 123.307 0.48 . . . . 0.0 112.521 -173.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -88.28 134.08 33.89 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.775 1.23 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -71.85 120.53 17.58 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.4 HD13 ' HB2' ' A' ' 37' ' ' ALA . 28.3 pt -108.3 -25.55 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 125.041 1.337 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.423 HD13 HG21 ' A' ' 113' ' ' VAL . 16.4 tp -140.32 151.42 45.03 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.286 1.034 . . . . 0.0 108.552 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.0 m -151.01 110.62 4.02 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.097 0.959 . . . . 0.0 108.649 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.448 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 18.8 m -63.57 165.32 8.22 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.314 0.646 . . . . 0.0 110.942 175.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.96 179.82 4.71 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.283 0.563 . . . . 0.0 111.414 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.74 114.75 22.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -106.17 142.39 35.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.197 0.999 . . . . 0.0 109.384 -178.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.0 t -65.52 -26.72 68.03 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.407 0.683 . . . . 0.0 111.454 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -139.41 150.42 45.24 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.01 0.924 . . . . 0.0 109.559 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.601 ' HB2' HD21 ' A' ' 23' ' ' LEU . 20.3 pttm -62.67 -26.57 68.72 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.613 0.571 . . . . 0.0 110.841 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.439 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 82.1 p -50.97 -47.36 61.31 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.091 1.357 . . . . 0.0 112.122 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.2 m -71.71 -26.63 62.57 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.74 . . . . 0.0 111.552 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.75 63.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.616 0.767 . . . . 0.0 110.23 174.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.83 -37.82 76.34 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.097 0.959 . . . . 0.0 110.206 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 53' ' ' THR . 29.2 mtpp -66.47 -33.53 75.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.608 170.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.06 -49.78 74.62 Favored Glycine 0 C--N 1.35 1.339 0 O-C-N 124.071 0.857 . . . . 0.0 112.762 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.508 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -70.42 -36.11 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 117.15 0.475 . . . . 0.0 110.9 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.54 -39.33 79.9 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.114 0.483 . . . . 0.0 110.301 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.1 m -74.47 -43.28 56.82 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.858 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.508 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -66.1 -28.79 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 119.11 0.868 . . . . 0.0 110.319 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.4 tpt85 -68.16 -39.23 82.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.678 0.791 . . . . 0.0 109.869 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.7 m -78.35 -24.05 46.65 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.691 0.796 . . . . 0.0 111.509 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -105.32 13.69 30.02 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.107 0.963 . . . . 0.0 111.21 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.9 m -55.93 -45.36 99.91 Favored Pre-proline 0 CA--C 1.569 1.676 0 C-N-CA 123.591 0.756 . . . . 0.0 112.148 172.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -87.93 -14.09 3.63 Favored 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 121.796 1.664 . . . . 0.0 113.951 175.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.38 93.12 4.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.033 0.533 . . . . 0.0 110.769 -170.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.09 -32.37 72.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.948 1.299 . . . . 0.0 112.565 -173.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -68.85 -26.04 64.95 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.551 0.74 . . . . 0.0 111.041 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -77.06 -26.05 53.13 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.572 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.468 ' HB3' HD12 ' A' ' 110' ' ' ILE . 95.9 m-85 -82.58 97.12 8.31 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 171.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -110.28 146.42 35.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.83 0.452 . . . . 0.0 109.888 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -87.01 149.32 24.84 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.798 1.239 . . . . 0.0 109.469 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -155.77 129.15 8.28 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.209 0.603 . . . . 0.0 109.857 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 48.2 m -92.27 121.42 33.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.954 0.502 . . . . 0.0 109.658 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 160.98 6.24 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.248 1.019 . . . . 0.0 111.908 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.2 t -72.37 -9.99 59.21 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.803 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -72.44 -10.32 59.65 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.744 0.818 . . . . 0.0 111.199 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.47 -6.05 84.02 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.35 0.5 . . . . 0.0 112.523 -175.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -92.28 159.15 15.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.735 0.814 . . . . 0.0 110.333 -174.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -105.75 128.89 53.97 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 -166.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.48 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 26.5 p90 -139.2 177.83 7.62 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -123.76 171.27 9.75 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.086 0.47 . . . . 0.0 110.07 176.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.42 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -148.08 121.78 9.24 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 124.154 0.981 . . . . 0.0 108.434 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.536 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -83.64 97.99 9.38 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -84.46 145.7 28.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.324 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -110.99 170.78 7.87 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.624 0.769 . . . . 0.0 110.839 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.29 -9.4 53.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.889 0.876 . . . . 0.0 111.673 173.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -88.01 6.26 36.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.229 1.011 . . . . 0.0 111.883 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 77.4 m80 69.92 -2.74 1.93 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 125.058 1.343 . . . . 0.0 112.34 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -99.06 150.98 21.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.432 0.693 . . . . 0.0 109.626 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.599 HG21 ' HB3' ' A' ' 96' ' ' SER . 50.4 mt -87.52 108.92 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 173.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.536 HD11 HD22 ' A' ' 86' ' ' LEU . 9.9 pt -79.32 -5.83 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.729 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . 178.67 113.91 0.39 Allowed Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 173.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.599 ' HB3' HG21 ' A' ' 93' ' ' ILE . 52.5 p -112.33 151.22 29.98 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.917 0.858 . . . . 0.0 109.743 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.9 t -81.11 166.49 20.65 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.31 -78.02 0.15 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.15 0.58 . . . . 0.0 109.87 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.48 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 23.3 ptm -175.75 122.51 0.19 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.283 1.033 . . . . 0.0 108.943 -176.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -102.97 115.86 31.43 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.97 90.9 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.039 0.536 . . . . 0.0 110.207 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.0 p -90.23 120.05 31.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.847 0.859 . . . . 0.0 109.226 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -24.64 65.9 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.207 1.003 . . . . 0.0 113.114 -171.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -65.94 -29.39 69.8 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.239 0.616 . . . . 0.0 111.868 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.8 m -71.77 -21.22 61.76 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.871 0.868 . . . . 0.0 111.417 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.72 -40.64 88.48 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.486 0.714 . . . . 0.0 109.529 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.86 -47.38 85.3 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.359 1.063 . . . . 0.0 110.919 174.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.1 m -60.75 -36.52 79.11 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.193 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -62.44 -42.53 99.7 Favored Glycine 0 C--N 1.35 1.311 0 O-C-N 123.627 0.58 . . . . 0.0 112.881 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.468 HD12 ' HB3' ' A' ' 72' ' ' TYR . 32.5 mm -58.09 -47.1 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.197 0.599 . . . . 0.0 110.145 175.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.87 -32.3 72.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.207 1.003 . . . . 0.0 111.602 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.0 t -74.2 -41.53 61.25 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.274 0.63 . . . . 0.0 110.306 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.423 HG21 HD13 ' A' ' 44' ' ' LEU . 94.1 t -75.91 -26.34 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.192 0.597 . . . . 0.0 110.684 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -64.41 -39.79 94.52 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.204 0.602 . . . . 0.0 109.845 169.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.1 -47.02 21.61 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.128 0.971 . . . . 0.0 111.878 -177.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -101.58 -2.72 29.85 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.674 0.79 . . . . 0.0 112.195 -170.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -75.91 -8.88 85.12 Favored Glycine 0 N--CA 1.475 1.287 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 82.7 p -80.25 -12.84 59.58 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.28 1.032 . . . . 0.0 111.567 174.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.8 m -69.97 118.23 12.55 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.904 0.882 . . . . 0.0 110.733 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -82.94 -17.71 42.65 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.409 0.683 . . . . 0.0 110.766 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.4 m -61.93 92.62 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.942 0.897 . . . . 0.0 112.425 -174.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 84.0 t -88.53 101.39 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.688 170.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -87.21 143.78 27.13 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 169.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -104.73 138.77 40.52 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.278 0.561 . . . . 0.0 110.819 -178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -129.94 -2.31 4.65 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.736 1.214 . . . . 0.0 109.912 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 37.1 p . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.043 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.469 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . . . . . . 0 C--O 1.241 0.579 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.468 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.2 p90 -154.76 168.84 25.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.677 0.791 . . . . 0.0 111.103 -171.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 46.1 m-85 -110.57 148.8 31.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.67 1.188 . . . . 0.0 108.438 172.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 39.3 mt-10 -133.39 111.28 10.64 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 171.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 31' ' ' PHE . 26.9 tp -83.37 100.29 10.59 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.417 0.627 . . . . 0.0 109.606 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m -93.83 178.41 5.68 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.688 1.195 . . . . 0.0 110.051 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -130.37 163.13 27.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.554 0.742 . . . . 0.0 109.442 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -120.98 -169.46 1.84 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.763 0.825 . . . . 0.0 110.523 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.0 m -63.46 -30.43 71.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.96 0.904 . . . . 0.0 112.657 -170.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -89.0 12.51 15.27 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.146 0.578 . . . . 0.0 111.267 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.6 t30 63.36 20.91 12.53 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.046 1.339 . . . . 0.0 110.48 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.23 142.08 28.17 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.732 0.813 . . . . 0.0 110.169 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.491 ' HB3' HD11 ' A' ' 23' ' ' LEU . 79.7 m-85 -90.96 130.71 36.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.905 1.282 . . . . 0.0 110.742 -165.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 46' ' ' SER . 47.5 ttm-85 -134.88 127.34 30.52 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.749 1.22 . . . . 0.0 108.611 -174.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.97 135.16 33.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.5 m -113.96 131.31 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 165.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.428 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.6 OUTLIER -104.56 115.66 30.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -113.92 138.88 49.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.506 0.722 . . . . 0.0 109.684 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 174.4 11.63 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.217 0.607 . . . . 0.0 109.941 170.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.84 -14.78 68.25 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.972 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -70.8 -11.56 61.03 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.722 1.209 . . . . 0.0 111.478 174.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 88.4 0.5 82.32 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.908 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -96.42 141.73 29.37 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.699 0.799 . . . . 0.0 110.997 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.4 m -79.1 119.89 22.86 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.011 0.819 . . . . 0.0 109.335 175.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.403 HD11 HD22 ' A' ' 35' ' ' LEU . 26.2 pt -92.35 -30.53 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.271 1.028 . . . . 0.0 111.106 -178.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.4 tp -148.55 150.59 33.62 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.808 0.843 . . . . 0.0 109.131 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.474 HG22 HH11 ' A' ' 32' ' ' ARG . 55.6 m -136.31 109.92 8.03 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.493 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 13.2 m -66.83 153.3 43.75 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.449 0.7 . . . . 0.0 109.682 173.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -82.89 -167.91 1.84 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.117 0.567 . . . . 0.0 112.195 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.18 145.21 37.8 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.464 0.706 . . . . 0.0 111.731 -173.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 96.2 m-85 -134.65 133.61 40.29 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.35 1.46 . . . . 0.0 107.732 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.4 m -61.39 -36.94 81.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.123 0.569 . . . . 0.0 110.707 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.6 m -126.31 150.68 48.34 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.333 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -67.99 -24.51 65.14 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.349 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -62.17 -36.34 81.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.45 0.7 . . . . 0.0 111.464 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.7 m -69.63 -35.38 75.18 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.229 0.612 . . . . 0.0 109.974 173.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.0 69.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.778 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -67.84 -34.82 77.45 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.25 0.62 . . . . 0.0 110.303 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -67.14 -35.88 80.67 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.099 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.21 -49.33 71.97 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 123.925 0.766 . . . . 0.0 113.337 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.5 tt -67.74 -33.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 116.961 0.38 . . . . 0.0 111.008 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.19 -37.61 87.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.845 0.458 . . . . 0.0 110.406 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.9 m -74.41 -39.5 62.61 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.029 -178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 20.2 m -67.23 -33.41 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.774 0.715 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -73.91 -35.16 64.6 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.894 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.6 t -76.25 -21.48 56.29 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.522 0.729 . . . . 0.0 110.673 176.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.565 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 0.9 OUTLIER -95.06 8.33 43.3 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.917 0.887 . . . . 0.0 110.885 176.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 39.8 t -67.49 -47.45 47.15 Favored Pre-proline 0 CA--C 1.572 1.819 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.397 171.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.93 -26.37 26.83 Favored 'Trans proline' 0 C--N 1.4 3.263 0 C-N-CA 121.957 1.771 . . . . 0.0 112.142 168.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 65' ' ' ASN . 12.0 mm100 -92.55 46.69 1.26 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.899 0.88 . . . . 0.0 109.191 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -67.44 -13.02 61.65 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -73.37 -26.04 60.84 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.786 0.834 . . . . 0.0 110.562 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.44 HH21 ' HG2' ' A' ' 73' ' ' GLU . 3.6 tpm_? -70.78 -16.29 62.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.899 0.88 . . . . 0.0 112.269 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -63.46 122.48 16.37 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 168.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HG2' HH21 ' A' ' 71' ' ' ARG . 38.0 mt-10 -94.6 110.92 22.7 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -172.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.03 104.31 1.11 Allowed 'General case' 0 C--N 1.353 0.741 0 O-C-N 123.9 0.75 . . . . 0.0 110.062 -178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -95.37 143.93 26.33 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.664 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.5 m -127.24 115.43 19.03 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.74 155.48 37.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.674 0.79 . . . . 0.0 110.573 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -68.63 -13.12 62.14 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.53 0.732 . . . . 0.0 110.685 175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -77.31 4.65 10.22 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.024 0.929 . . . . 0.0 111.713 172.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.21 17.86 77.67 Favored Glycine 0 C--N 1.351 1.413 0 C-N-CA 122.885 0.278 . . . . 0.0 113.089 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -104.7 125.8 51.15 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.831 0.852 . . . . 0.0 110.274 -176.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -79.7 137.42 37.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 172.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -150.83 176.81 10.71 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -138.21 140.82 39.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 122.048 -0.408 . . . . 0.0 110.483 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -110.74 114.34 27.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 171.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -80.73 125.29 29.87 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -109.58 138.99 45.13 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.071 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.22 161.81 13.95 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.44 0.696 . . . . 0.0 110.685 175.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.72 69.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.921 0.888 . . . . 0.0 111.323 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.41 12.26 3.81 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.555 1.142 . . . . 0.0 112.539 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 66.35 14.11 9.53 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.853 1.261 . . . . 0.0 111.677 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -88.9 128.85 35.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.494 0.718 . . . . 0.0 109.135 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.8 96.91 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.7 pt -83.46 -7.07 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.081 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -162.59 145.18 10.36 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 173.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.9 p -155.45 118.78 4.4 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.3 t -81.76 164.42 21.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 122.758 0.423 . . . . 0.0 110.615 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -75.02 -84.59 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.119 0.568 . . . . 0.0 110.085 -176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 12.7 ptp -164.55 129.73 2.74 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.975 0.91 . . . . 0.0 109.504 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 81.0 m-85 -104.25 131.76 51.22 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.649 0.78 . . . . 0.0 109.719 173.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.37 -31.37 72.02 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.958 0.903 . . . . 0.0 111.645 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 17.5 p -140.81 165.64 26.96 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.976 0.91 . . . . 0.0 110.557 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -30.7 69.53 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.399 1.08 . . . . 0.0 112.065 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -61.11 -37.44 82.8 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 123.953 0.783 . . . . 0.0 111.385 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.485 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 21.5 m -74.58 -30.78 61.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.01 0.924 . . . . 0.0 110.569 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -39.4 88.69 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.085 0.954 . . . . 0.0 110.089 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.43 -36.93 77.14 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.795 0.838 . . . . 0.0 110.71 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.0 m -62.86 -37.63 87.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.529 0.732 . . . . 0.0 109.482 172.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.432 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.92 -48.56 82.84 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.427 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.0 mm -55.23 -50.01 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.331 0.652 . . . . 0.0 110.095 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.69 -39.35 84.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 13.7 t -76.15 -36.01 58.95 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.86 -175.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 109' ' ' GLY . 85.5 t -71.16 -31.9 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 118.141 0.428 . . . . 0.0 110.198 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -69.23 -43.37 74.19 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.633 0.373 . . . . 0.0 110.766 174.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.71 -48.15 56.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.565 0.746 . . . . 0.0 111.327 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.469 ' ND2' ' HA3' ' A' ' 19' ' ' GLY . 22.4 m120 -88.8 -10.54 47.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.874 0.87 . . . . 0.0 111.576 -175.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.44 -37.15 89.93 Favored Glycine 0 C--N 1.346 1.136 0 O-C-N 123.245 0.341 . . . . 0.0 112.785 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.1 t -75.78 -11.14 59.93 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.934 0.894 . . . . 0.0 112.239 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.2 m -69.5 104.56 2.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.179 0.592 . . . . 0.0 110.135 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -86.28 72.47 10.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.222 1.011 . . . . 0.0 108.802 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.468 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.1 t -145.42 93.83 2.43 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.041 -1.436 . . . . 0.0 108.898 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.2 t -109.24 123.79 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.974 0.91 . . . . 0.0 110.542 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -100.7 90.26 4.18 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 174.289 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.94 97.16 1.8 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.405 ' ND2' ' HB3' ' A' ' 22' ' ' GLU . 87.2 m-20 -84.54 -4.12 58.79 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.561 1.144 . . . . 0.0 112.445 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.416 HG21 ' HD1' ' A' ' 31' ' ' PHE . 47.3 p . . . . . 0 CA--C 1.543 0.677 0 C-N-CA 123.315 0.646 . . . . 0.0 111.202 -176.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.547 0 N-CA-C 111.92 -0.472 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.2 p90 -159.05 150.13 20.12 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.799 0.839 . . . . 0.0 109.88 -178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -90.57 157.48 17.49 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.607 0.763 . . . . 0.0 109.56 172.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.477 ' HA ' ' HB3' ' A' ' 123' ' ' LYS . 55.3 mt-10 -136.09 110.49 8.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.69 0.796 . . . . 0.0 109.565 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.457 HD21 ' HG3' ' A' ' 52' ' ' LYS . 29.2 tp -94.18 101.68 13.68 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.197 0.599 . . . . 0.0 109.849 -178.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.551 ' HA ' ' HB3' ' A' ' 125' ' ' ASN . 22.3 m -107.04 174.49 5.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.239 1.016 . . . . 0.0 110.702 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.39 151.65 36.59 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.199 0.999 . . . . 0.0 109.58 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.8 m -89.43 -177.65 5.39 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.771 0.829 . . . . 0.0 111.428 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.6 t -61.92 -34.82 76.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.952 0.901 . . . . 0.0 110.943 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.38 11.52 36.33 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.782 0.833 . . . . 0.0 111.078 176.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 t30 69.42 33.78 3.06 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 125.349 1.46 . . . . 0.0 112.559 174.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -81.12 139.27 35.73 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 121.748 -0.595 . . . . 0.0 110.027 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -90.16 117.47 28.95 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.393 1.077 . . . . 0.0 109.485 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -130.18 119.29 22.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.062 0.945 . . . . 0.0 109.264 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -95.24 130.54 41.94 Favored 'General case' 0 C--O 1.241 0.615 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 45' ' ' THR . 20.7 m -106.12 170.75 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 170.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.2 125.27 42.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -112.81 138.81 49.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.97 178.49 1.78 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.454 0.702 . . . . 0.0 111.305 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -19.86 61.46 Favored Glycine 0 C--N 1.35 1.327 0 CA-C-N 116.585 -0.28 . . . . 0.0 113.031 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -67.8 -24.35 65.29 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.598 0.759 . . . . 0.0 111.779 173.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.37 15.5 58.58 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 116.537 -0.302 . . . . 0.0 113.025 -175.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -106.77 141.46 37.98 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.421 0.689 . . . . 0.0 110.317 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.9 m -67.77 122.29 17.79 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 123.602 0.564 . . . . 0.0 110.861 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.5 pt -109.85 -18.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.775 1.23 . . . . 0.0 110.651 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 tp -151.06 145.94 25.84 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.498 HG23 HG12 ' A' ' 34' ' ' VAL . 92.5 m -146.4 119.06 8.56 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.842 0.857 . . . . 0.0 108.813 178.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -82.0 177.26 8.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.919 0.487 . . . . 0.0 111.335 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -73.22 175.43 6.82 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.346 1.059 . . . . 0.0 111.725 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.0 114.65 27.25 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.414 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -99.56 147.33 25.45 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.069 0.948 . . . . 0.0 109.323 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.6 p -81.09 -31.99 34.1 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.83 0.452 . . . . 0.0 111.297 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.2 m -109.15 143.7 38.2 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.953 0.901 . . . . 0.0 109.703 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HG3' HD21 ' A' ' 23' ' ' LEU . 87.3 tttt -67.93 -37.89 82.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.978 0.511 . . . . 0.0 110.412 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.172 0.989 . . . . 0.0 111.695 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 m -64.12 -39.2 93.52 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.072 0.949 . . . . 0.0 111.25 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.97 -34.67 66.61 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.578 0.751 . . . . 0.0 110.886 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.94 -29.63 65.71 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.575 0.75 . . . . 0.0 111.1 177.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -77.96 -27.41 49.23 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.322 0.249 . . . . 0.0 111.275 170.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.85 -40.84 99.37 Favored Glycine 0 C--N 1.344 1.002 0 O-C-N 123.525 0.516 . . . . 0.0 112.827 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.449 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.4 tt -68.01 -32.82 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 120.91 0.386 . . . . 0.0 111.067 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.17 74.15 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.071 0.548 . . . . 0.0 110.677 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -70.84 -50.83 31.11 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.879 0.871 . . . . 0.0 111.344 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 59' ' ' ILE . 30.7 m -66.18 -28.84 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.293 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -53.16 -50.97 63.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.681 0.793 . . . . 0.0 110.334 -178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -80.79 -31.99 35.54 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.826 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB3' HD11 ' A' ' 86' ' ' LEU . 14.1 m120 -96.06 -8.4 33.6 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 p -65.28 -37.02 17.24 Favored Pre-proline 0 CA--C 1.566 1.584 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -74.13 -7.9 20.37 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.768 1.645 . . . . 0.0 112.993 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.79 88.93 4.44 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 122.923 0.489 . . . . 0.0 109.768 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.458 ' HA ' ' HD1' ' A' ' 72' ' ' TYR . 12.2 pt-20 -62.02 -20.19 63.65 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.801 0.84 . . . . 0.0 111.685 176.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -54.3 -40.74 68.2 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.457 1.103 . . . . 0.0 112.044 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -83.69 -9.43 58.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.514 0.726 . . . . 0.0 112.095 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 85' ' ' ASN . 88.8 m-85 -84.01 124.65 31.28 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.445 ' HB2' ' ND2' ' A' ' 85' ' ' ASN . 41.9 mt-10 -95.5 104.11 16.0 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 173.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -73.14 101.77 3.41 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.731 0.777 . . . . 0.0 109.136 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HE2' ' ND2' ' A' ' 85' ' ' ASN . 65.9 mttm -102.57 165.05 11.31 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.513 1.125 . . . . 0.0 109.937 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.8 m -126.3 112.2 15.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.312 0.645 . . . . 0.0 109.605 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.0 165.54 6.8 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.841 0.856 . . . . 0.0 111.02 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -64.3 -16.31 61.92 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.585 0.754 . . . . 0.0 111.98 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -81.35 -2.05 47.75 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.956 0.902 . . . . 0.0 111.986 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 77.94 14.97 81.76 Favored Glycine 0 C--N 1.349 1.27 0 C-N-CA 122.831 0.253 . . . . 0.0 112.935 -176.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.64 142.68 29.15 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.886 0.874 . . . . 0.0 109.535 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -101.23 125.48 47.86 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.865 0.466 . . . . 0.0 109.832 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.454 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 35.7 p90 -131.74 170.54 14.67 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.505 ' HB2' ' HB3' ' A' ' 97' ' ' SER . 16.6 m-85 -131.22 166.89 20.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.942 0.497 . . . . 0.0 110.142 -173.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.558 ' ND2' ' HE2' ' A' ' 75' ' ' LYS . 4.0 p30 -149.77 133.06 16.45 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 167.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 65' ' ' ASN . 27.2 tp -89.78 116.24 27.73 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -96.88 140.47 31.39 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.933 -176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -98.15 166.04 11.6 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.826 0.85 . . . . 0.0 109.748 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.07 -13.84 62.32 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.088 0.555 . . . . 0.0 111.634 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.478 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 64.4 m-20 -80.1 4.1 18.34 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.816 0.847 . . . . 0.0 111.296 174.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 74.3 m80 67.25 15.46 9.99 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.02 1.328 . . . . 0.0 111.788 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.478 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 13.4 pt20 -97.67 147.02 24.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.194 0.598 . . . . 0.0 110.426 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.96 99.72 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 13.0 pt -81.22 -16.51 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.756 -177.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.83 103.26 0.2 Allowed Glycine 0 C--N 1.35 1.335 0 C-N-CA 121.701 -0.285 . . . . 0.0 113.046 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 85' ' ' ASN . 39.8 t -92.86 113.56 25.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.661 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.505 ' HB3' ' HB2' ' A' ' 84' ' ' PHE . 46.6 t -81.8 135.85 35.43 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -75.43 172.5 12.4 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.454 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.07 118.08 16.6 Favored 'General case' 0 C--N 1.351 0.651 0 CA-C-O 121.801 0.81 . . . . 0.0 112.045 -171.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -93.95 137.09 33.55 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.485 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.16 -56.51 4.58 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.259 0.624 . . . . 0.0 110.818 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.3 p -88.26 151.68 22.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.511 0.724 . . . . 0.0 112.241 -171.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.91 -24.84 60.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.407 1.083 . . . . 0.0 111.973 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -65.81 -37.56 86.58 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.5 m -74.75 -18.59 60.47 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.249 1.02 . . . . 0.0 111.816 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -60.75 -48.95 79.46 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 173.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.7 -48.13 23.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.958 0.903 . . . . 0.0 111.043 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.8 m -61.38 -28.72 69.44 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.704 0.802 . . . . 0.0 111.265 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.449 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -66.26 -51.65 42.22 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.744 178.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.7 mm -65.48 -38.07 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 122.843 0.457 . . . . 0.0 110.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -30.57 71.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.961 0.904 . . . . 0.0 111.486 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.91 -50.08 18.08 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 109' ' ' GLY . 66.2 t -62.17 -36.63 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 C-N-CA 122.972 0.509 . . . . 0.0 111.778 -175.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -69.95 -39.44 76.03 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 120.705 0.288 . . . . 0.0 111.337 178.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.48 -41.57 46.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.326 0.651 . . . . 0.0 111.434 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -91.08 -10.77 40.84 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.5 0.72 . . . . 0.0 110.782 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.22 -12.46 84.58 Favored Glycine 0 C--N 1.354 1.542 0 C-N-CA 122.842 0.258 . . . . 0.0 113.572 177.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.2 p -81.92 -18.31 44.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.259 0.623 . . . . 0.0 111.016 172.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.3 m -76.06 90.34 3.04 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 123.449 0.7 . . . . 0.0 110.046 -178.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.446 ' HA ' HD11 ' A' ' 59' ' ' ILE . 11.7 mm100 -82.93 67.75 9.14 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 122.185 0.993 . . . . 0.0 109.597 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.6 t -136.65 93.3 2.85 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.0 -1.454 . . . . 0.0 109.244 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 35.4 m -85.93 141.4 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.183 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.477 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 55.5 tptt -97.07 99.3 10.81 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 174.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.85 95.24 1.91 Allowed 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.134 -175.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 24' ' ' SER . 26.5 t-20 -79.06 -26.64 43.05 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 165.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 CA--C 1.548 0.865 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.35 171.519 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.453 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -147.65 148.32 30.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.038 0.935 . . . . 0.0 109.936 -176.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -97.17 118.83 34.48 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -95.58 109.02 21.32 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.61 HD21 ' HB2' ' A' ' 52' ' ' LYS . 49.4 tp -79.72 101.47 8.43 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -103.52 139.8 38.37 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.922 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 126' ' ' THR . 14.8 ptmm? -95.44 130.13 42.36 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 170.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.4 m -83.98 -178.49 6.99 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 109.882 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -59.94 -25.76 65.42 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.066 0.546 . . . . 0.0 112.259 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -102.31 25.71 8.61 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.848 0.859 . . . . 0.0 111.086 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 63.88 12.18 6.58 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 125.035 1.334 . . . . 0.0 112.829 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -69.44 126.25 29.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.344 0.658 . . . . 0.0 110.941 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.48 119.95 30.37 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.195 0.998 . . . . 0.0 109.475 -170.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HB2' HD13 ' A' ' 48' ' ' LEU . 47.2 ttp85 -147.9 117.78 7.17 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.837 0.855 . . . . 0.0 108.972 -173.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -90.99 128.08 36.67 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 45' ' ' THR . 30.5 m -107.06 130.89 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.694 0.797 . . . . 0.0 108.892 173.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.2 tp -89.77 112.93 24.37 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -105.29 129.29 53.68 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.305 1.042 . . . . 0.0 109.059 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.31 -176.98 1.99 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.937 0.495 . . . . 0.0 110.995 173.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.41 -15.06 51.39 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 115.434 0.934 . . . . 0.0 115.434 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -79.77 -14.22 58.87 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.473 0.709 . . . . 0.0 111.723 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.09 6.87 78.25 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 -165.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -84.12 117.43 23.46 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 124.465 1.106 . . . . 0.0 109.961 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.7 m -64.93 119.73 11.26 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 171.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.1 pt -104.91 -24.93 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.292 1.037 . . . . 0.0 109.993 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 13.0 tp -145.61 134.26 22.19 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -170.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.53 HG23 HG12 ' A' ' 34' ' ' VAL . 59.7 m -132.74 123.64 26.63 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.759 0.823 . . . . 0.0 108.951 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 t -83.52 -179.29 7.31 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.292 0.637 . . . . 0.0 111.408 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 93' ' ' ILE . 27.1 mm-40 -68.75 170.32 9.68 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.588 0.755 . . . . 0.0 111.643 174.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.8 mm? -89.65 113.67 25.18 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 171.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -99.1 152.15 20.17 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 124.42 1.088 . . . . 0.0 109.859 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 65.5 p -82.84 -17.58 43.44 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.515 0.726 . . . . 0.0 110.932 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.0 m -138.23 149.51 45.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.114 0.966 . . . . 0.0 110.076 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.61 ' HB2' HD21 ' A' ' 23' ' ' LEU . 3.1 pptp? -71.88 -27.17 62.67 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.194 0.598 . . . . 0.0 110.444 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 14.8 t -68.77 -27.86 66.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.989 0.516 . . . . 0.0 111.046 174.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 14.6 m -69.31 -36.42 76.99 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.034 0.534 . . . . 0.0 109.637 174.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.88 -30.94 67.45 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.167 174.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -64.39 -43.64 93.83 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.883 0.873 . . . . 0.0 110.479 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 53' ' ' THR . 2.8 mmmp? -64.9 -34.05 77.49 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.981 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.63 -49.55 68.3 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.352 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.9 tt -71.4 -32.24 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 122.607 0.363 . . . . 0.0 111.076 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.95 -38.69 86.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.158 0.504 . . . . 0.0 109.796 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.6 m -71.48 -43.22 66.97 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.796 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 m -62.36 -32.65 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 118.897 0.771 . . . . 0.0 110.608 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.484 HH22 ' N ' ' A' ' 120' ' ' GLN . 14.9 ttm180 -70.39 -40.11 74.15 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.677 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -68.63 -22.28 64.43 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.101 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.48 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 60.7 m-80 -98.54 -1.94 39.91 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.441 0.696 . . . . 0.0 112.156 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.1 m -63.15 -45.76 85.85 Favored Pre-proline 0 CA--C 1.568 1.663 0 CA-C-O 118.275 -0.869 . . . . 0.0 111.657 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.8 -37.88 8.47 Favored 'Trans proline' 0 C--N 1.398 3.158 0 C-N-CA 121.762 1.641 . . . . 0.0 111.812 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' A' ' 65' ' ' ASN . 9.5 pt20 -98.66 58.28 1.2 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.934 1.35 . . . . 0.0 109.408 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.27 -11.71 34.29 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 113.27 -1.786 . . . . 0.0 112.899 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.19 -25.01 65.03 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.868 0.867 . . . . 0.0 111.894 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.69 -15.6 61.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.011 0.524 . . . . 0.0 112.367 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.82 127.39 31.36 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -96.92 107.33 19.82 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.506 0.722 . . . . 0.0 111.532 -168.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -73.51 112.0 9.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.034 0.534 . . . . 0.0 109.76 174.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.411 ' HE2' ' OD1' ' A' ' 85' ' ' ASN . 55.1 mtmt -134.36 143.5 47.69 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 171.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.3 m -101.49 133.36 46.26 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.55 0.74 . . . . 0.0 109.71 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.4 11.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.121 0.968 . . . . 0.0 111.649 176.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 p -64.47 -25.97 68.23 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.892 0.877 . . . . 0.0 111.473 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -70.02 -23.75 63.17 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.643 0.777 . . . . 0.0 111.332 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.62 30.91 5.97 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.317 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -113.55 125.9 54.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.409 0.683 . . . . 0.0 110.921 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -83.1 128.6 34.63 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.058 0.943 . . . . 0.0 110.391 -170.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -138.37 173.58 11.46 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -131.09 135.53 47.59 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.411 ' OD1' ' HE2' ' A' ' 75' ' ' LYS . 5.2 p-10 -115.51 129.51 56.56 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -91.69 99.38 12.29 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 173.362 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -106.55 135.97 47.13 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.216 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.472 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -100.85 170.71 8.13 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.33 1.052 . . . . 0.0 111.052 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.11 -8.95 13.72 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.509 0.723 . . . . 0.0 112.936 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.463 HD22 ' N ' ' A' ' 90' ' ' ASN . 0.7 OUTLIER -84.65 7.87 18.86 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.082 0.953 . . . . 0.0 111.311 175.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 87' ' ' LYS . 30.7 m170 63.97 21.94 12.79 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.971 1.309 . . . . 0.0 111.687 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -116.82 129.85 56.34 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.831 0.853 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 96' ' ' SER . 40.0 mt -74.05 100.73 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 122.076 0.941 . . . . 0.0 109.519 173.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 86' ' ' LEU . 16.2 pt -75.66 -6.57 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.279 -176.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.01 99.14 0.13 Allowed Glycine 0 C--N 1.353 1.491 0 CA-C-O 120.082 -0.288 . . . . 0.0 112.528 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 93' ' ' ILE . 34.3 p -92.45 116.77 29.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.4 t -69.39 164.5 22.84 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 122.975 0.51 . . . . 0.0 111.248 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -73.0 156.12 39.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.54 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 67.7 mtm -72.9 116.97 14.05 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -90.63 143.5 26.68 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 124.003 0.921 . . . . 0.0 109.17 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.04 -39.38 79.23 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.021 0.528 . . . . 0.0 110.675 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 65.3 p -117.16 150.24 39.03 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.696 0.798 . . . . 0.0 110.949 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -69.78 -25.77 63.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.052 0.941 . . . . 0.0 111.909 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.86 -29.98 68.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.686 0.394 . . . . 0.0 111.535 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -71.27 -23.99 62.07 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.123 0.569 . . . . 0.0 111.318 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.436 ' O ' HG12 ' A' ' 110' ' ' ILE . 13.1 ttt180 -61.34 -49.55 76.53 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.203 0.601 . . . . 0.0 109.754 169.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.31 -38.11 88.14 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.155 0.982 . . . . 0.0 111.223 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 48.4 m -66.32 -37.28 85.02 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.178 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.33 -35.84 88.37 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.903 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 106' ' ' ARG . 43.6 mm -59.83 -46.67 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.02 -35.66 81.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.831 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.6 t -71.1 -42.93 68.65 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.708 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.92 -27.08 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.506 0.723 . . . . 0.0 111.058 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -66.04 -47.42 74.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.011 0.925 . . . . 0.0 108.997 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.39 -47.69 22.39 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.647 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.461 ' HB3' HD11 ' A' ' 35' ' ' LEU . 77.9 m-20 -83.66 -14.37 51.98 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.51 0.724 . . . . 0.0 111.952 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -70.62 -30.57 68.53 Favored Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.104 -0.399 . . . . 0.0 112.104 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -91.17 9.18 32.18 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.025 0.93 . . . . 0.0 111.343 175.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -103.51 108.68 20.04 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.182 0.993 . . . . 0.0 108.852 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.484 ' N ' HH22 ' A' ' 63' ' ' ARG . 48.5 tt0 -92.82 38.66 1.03 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.276 0.63 . . . . 0.0 111.108 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.3 m -79.26 75.72 5.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 t -91.04 97.5 7.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -77.54 125.55 29.52 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.652 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -77.47 95.17 4.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 172.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.32 -0.75 57.23 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 121.595 0.712 . . . . 0.0 109.44 174.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.424 HG22 ' HB3' ' A' ' 25' ' ' LYS . 25.9 p . . . . . 0 CA--C 1.549 0.908 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 169.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.485 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -145.16 150.06 36.08 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.413 1.085 . . . . 0.0 110.186 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -95.34 153.03 17.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.843 0.857 . . . . 0.0 109.46 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -133.32 109.77 9.6 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.5 tp -82.01 102.0 10.69 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -101.11 -177.63 3.51 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.432 1.093 . . . . 0.0 109.507 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 18.7 ptpt -138.71 165.9 25.77 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.041 0.536 . . . . 0.0 109.757 169.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.3 t -100.55 -174.07 2.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.861 0.864 . . . . 0.0 108.878 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 t -62.28 -35.28 78.53 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.458 0.703 . . . . 0.0 111.525 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -90.79 26.37 2.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.154 0.582 . . . . 0.0 111.532 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.508 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.2 m-20 62.99 19.22 11.5 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.536 1.134 . . . . 0.0 112.263 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -71.52 116.5 11.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.671 0.788 . . . . 0.0 109.731 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.5 120.61 28.02 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.001 0.521 . . . . 0.0 110.06 -168.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 ttt85 -142.51 116.25 9.23 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.028 1.331 . . . . 0.0 108.116 -170.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -102.91 145.83 29.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.241 0.544 . . . . 0.0 110.597 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.573 HG12 HG23 ' A' ' 45' ' ' THR . 29.5 m -106.86 171.4 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 108.789 175.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 24.3 tp -137.54 109.56 7.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 173.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 65.5 mttm -95.14 141.93 28.18 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 178.05 7.01 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 168.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.52 -18.22 63.21 Favored Glycine 0 N--CA 1.48 1.596 0 C-N-CA 122.898 0.285 . . . . 0.0 113.035 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -63.73 -21.57 66.47 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 125.156 1.382 . . . . 0.0 111.89 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.82 2.22 75.66 Favored Glycine 0 C--N 1.35 1.354 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -173.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -98.35 130.43 45.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.918 1.287 . . . . 0.0 109.818 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 30.4 m -72.34 121.47 19.53 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.391 0.615 . . . . 0.0 110.532 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -99.99 -24.37 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.92 1.288 . . . . 0.0 111.5 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -146.1 143.62 29.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.573 HG23 HG12 ' A' ' 34' ' ' VAL . 48.2 m -146.15 114.48 6.68 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.308 0.643 . . . . 0.0 109.71 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 m -69.39 164.29 23.3 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.931 0.892 . . . . 0.0 111.347 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -83.39 178.19 8.15 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.394 0.616 . . . . 0.0 111.948 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.57 113.36 11.74 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.222 -177.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.76 156.78 16.18 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.006 0.922 . . . . 0.0 109.002 171.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.7 m -82.31 -24.47 34.61 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 173.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.7 t -126.61 146.87 50.0 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.365 0.666 . . . . 0.0 111.316 -174.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.5 ' HD3' ' H ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -75.08 -27.84 60.09 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.207 176.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.7 m -63.49 -38.42 91.07 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.54 1.536 . . . . 0.0 110.925 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.3 m -65.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.551 0.74 . . . . 0.0 110.606 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.31 -30.81 57.87 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.158 0.983 . . . . 0.0 111.92 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -73.98 -38.08 64.26 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.516 0.726 . . . . 0.0 110.143 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -22.79 52.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.248 169.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.97 93.36 Favored Glycine 0 C--N 1.349 1.281 0 O-C-N 123.745 0.653 . . . . 0.0 112.655 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.494 ' HA ' HG22 ' A' ' 62' ' ' VAL . 5.7 tt -65.55 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 122.341 0.256 . . . . 0.0 110.37 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -35.76 81.56 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.074 0.55 . . . . 0.0 110.893 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.9 m -73.7 -43.84 58.17 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.57 0.748 . . . . 0.0 111.621 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.494 HG22 ' HA ' ' A' ' 59' ' ' ILE . 18.8 m -70.11 -29.11 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -67.89 -45.14 75.33 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.919 0.888 . . . . 0.0 108.887 176.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 42.6 t -64.97 -15.79 62.63 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.076 0.95 . . . . 0.0 111.892 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.99 18.47 9.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.443 0.697 . . . . 0.0 112.392 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -63.19 -45.85 85.67 Favored Pre-proline 0 CA--C 1.567 1.619 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.195 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.64 -12.81 11.03 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 121.614 1.543 . . . . 0.0 113.093 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -75.98 84.66 2.88 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.484 0.659 . . . . 0.0 110.868 -173.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.06 -28.7 70.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.147 1.379 . . . . 0.0 112.045 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -63.24 -35.82 81.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.659 0.783 . . . . 0.0 110.824 174.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.432 ' HA ' ' NE ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.19 -19.99 35.48 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.453 -174.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -70.83 106.3 3.55 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 167.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -97.63 107.4 19.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.494 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.99 123.69 43.45 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.118 0.967 . . . . 0.0 109.75 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -132.99 150.65 52.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.844 1.257 . . . . 0.0 109.633 -175.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.2 m -92.79 117.26 29.82 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.581 0.752 . . . . 0.0 109.518 171.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.86 163.53 7.46 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.078 0.951 . . . . 0.0 112.235 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -68.58 -14.68 63.18 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.269 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -82.79 1.87 36.85 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.086 0.955 . . . . 0.0 111.772 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.81 32.91 58.52 Favored Glycine 0 C--N 1.353 1.506 0 C-N-CA 123.121 0.391 . . . . 0.0 112.951 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 74.8 mmtt -122.94 150.28 43.16 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.114 0.965 . . . . 0.0 109.728 -177.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -96.57 126.82 42.02 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.307 0.643 . . . . 0.0 109.987 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -137.79 176.69 8.48 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -141.46 166.14 25.56 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.907 0.483 . . . . 0.0 110.116 173.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -148.51 135.57 20.12 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.694 HD12 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -88.51 119.41 28.93 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -93.16 139.28 30.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.318 1.047 . . . . 0.0 109.896 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.2 176.1 7.09 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.279 0.632 . . . . 0.0 110.643 177.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.63 -23.71 65.38 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 121.448 0.642 . . . . 0.0 110.126 169.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -79.56 -3.81 48.6 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.728 174.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.6 m80 65.42 15.57 10.09 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 125.737 1.615 . . . . 0.0 111.235 -175.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -88.23 154.7 20.22 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 123.703 0.801 . . . . 0.0 110.048 177.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.476 HG21 ' HB2' ' A' ' 96' ' ' SER . 13.9 mm -84.14 99.16 6.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.694 HD11 HD12 ' A' ' 86' ' ' LEU . 10.0 pt -83.6 -8.38 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 122.801 0.44 . . . . 0.0 111.82 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.76 103.85 0.19 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.802 -0.443 . . . . 0.0 112.293 176.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.476 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.6 t -100.57 119.39 38.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.805 0.842 . . . . 0.0 109.229 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.3 t -73.77 167.33 21.63 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.94 0.496 . . . . 0.0 110.8 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.453 ' NE2' ' HB ' ' A' ' 42' ' ' THR . 77.5 mt-30 -85.38 166.63 16.26 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.382 0.673 . . . . 0.0 110.494 177.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 72.1 mtm -74.35 118.63 17.54 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.579 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -94.41 144.3 25.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.124 0.97 . . . . 0.0 109.005 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.536 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -62.25 -58.02 9.28 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.418 0.687 . . . . 0.0 110.707 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.7 p -110.73 169.15 8.95 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.022 0.929 . . . . 0.0 110.954 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.74 -30.01 65.15 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.97 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -64.41 -32.49 74.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.109 0.564 . . . . 0.0 110.971 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.4 t -79.05 -32.89 45.02 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.755 0.822 . . . . 0.0 110.426 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -69.22 -38.72 78.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.724 0.81 . . . . 0.0 111.515 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -75.61 -29.87 59.38 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 122.95 0.5 . . . . 0.0 111.281 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 47.0 m -65.83 -34.31 77.86 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.43 -46.22 93.11 Favored Glycine 0 C--N 1.351 1.372 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.153 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.0 mm -55.09 -46.84 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.54 0.736 . . . . 0.0 109.839 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.22 93.16 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.9 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.7 t -71.63 -46.57 58.66 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.205 0.602 . . . . 0.0 110.361 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 81.0 t -64.86 -30.9 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.943 0.897 . . . . 0.0 111.124 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.92 -51.5 54.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.362 0.665 . . . . 0.0 110.405 173.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.84 -20.94 55.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.802 0.841 . . . . 0.0 112.431 -172.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -112.17 -8.16 14.01 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.824 0.849 . . . . 0.0 111.051 -178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.74 -28.13 65.72 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 172.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 12.6 t -74.25 -9.36 58.53 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.0 0.92 . . . . 0.0 111.83 175.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.4 t -72.92 147.01 45.71 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.206 0.602 . . . . 0.0 109.437 176.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -131.46 25.21 4.8 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.589 0.756 . . . . 0.0 110.657 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.4 t -95.88 110.84 22.96 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 172.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.3 t -119.27 117.32 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 110.209 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -78.27 135.74 37.61 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.124 . . . . 0.0 109.182 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -89.02 107.99 19.34 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -114.76 15.39 17.52 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.657 0.783 . . . . 0.0 110.305 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.6 p . . . . . 0 N--CA 1.485 1.29 0 C-N-CA 123.431 0.692 . . . . 0.0 111.745 -175.351 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.529 0 CA-C-O 121.094 0.274 . . . . 0.0 113.751 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -165.39 155.52 13.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.296 1.038 . . . . 0.0 109.842 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' HD13 ' A' ' 35' ' ' LEU . 59.6 m-85 -97.4 148.41 23.21 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.575 0.75 . . . . 0.0 109.937 169.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -129.75 117.61 20.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.852 0.861 . . . . 0.0 108.703 170.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 31' ' ' PHE . 28.7 tp -81.63 102.45 10.68 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 175.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.1 m -106.49 162.84 13.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.217 1.007 . . . . 0.0 108.816 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -121.44 165.68 15.23 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 61.0 p -96.75 173.79 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 123.932 0.893 . . . . 0.0 110.034 176.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.1 t -67.46 -21.72 65.53 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.351 0.596 . . . . 0.0 110.244 171.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.78 -13.14 60.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.321 1.048 . . . . 0.0 111.657 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 86.0 -7.04 0.8 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 126.348 1.859 . . . . 0.0 112.4 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.642 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 8.7 mp0 -65.63 132.96 50.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.196 0.598 . . . . 0.0 110.675 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.521 ' HB3' HD11 ' A' ' 23' ' ' LEU . 83.7 m-85 -91.31 148.54 22.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.358 1.063 . . . . 0.0 110.58 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -152.59 129.9 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.433 0.693 . . . . 0.0 109.306 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -91.21 126.93 36.45 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 173.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.38 130.27 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -99.25 123.01 43.2 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 173.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -118.68 149.51 41.29 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.259 1.024 . . . . 0.0 108.901 177.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.84 -179.15 6.4 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.441 0.696 . . . . 0.0 110.242 172.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.44 -20.27 65.41 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-O 120.997 0.221 . . . . 0.0 112.99 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -78.43 -10.3 59.64 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.293 1.037 . . . . 0.0 111.186 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.81 -0.66 89.15 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 123.035 0.35 . . . . 0.0 113.067 -175.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.38 121.76 20.06 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.064 0.945 . . . . 0.0 110.132 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 m -71.39 120.2 16.63 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 35' ' ' LEU . 26.7 pt -109.98 -8.35 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.699 1.2 . . . . 0.0 111.159 -177.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 16.9 tp -164.31 151.25 11.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.153 0.581 . . . . 0.0 110.487 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 46.7 m -146.1 126.34 13.89 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.462 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 87.3 p -67.01 155.13 39.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.35 0.66 . . . . 0.0 111.031 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.86 138.39 58.14 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 10.4 mp -64.07 111.97 2.77 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.199 0.523 . . . . 0.0 110.582 -173.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.3 m-85 -82.34 147.6 28.76 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.247 1.019 . . . . 0.0 110.657 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 m -69.76 -37.24 76.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.562 0.745 . . . . 0.0 110.886 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -112.69 155.33 24.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.564 0.746 . . . . 0.0 110.848 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -62.91 -43.18 99.48 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.946 0.898 . . . . 0.0 109.14 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.5 p -61.02 -40.78 94.85 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.086 0.866 . . . . 0.0 110.917 -177.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 20.0 m -63.13 -39.97 96.23 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.613 0.765 . . . . 0.0 110.931 178.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.2 84.32 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.527 0.731 . . . . 0.0 110.992 176.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -68.66 -32.11 71.71 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.667 0.787 . . . . 0.0 111.082 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -77.82 -22.94 49.25 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.086 0.554 . . . . 0.0 110.949 171.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.57 94.83 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.819 0.699 . . . . 0.0 113.778 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.5 tt -64.16 -37.79 80.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 117.02 0.41 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.96 71.27 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.289 0.635 . . . . 0.0 110.952 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 m -73.14 -49.96 25.32 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.624 177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 59' ' ' ILE . 26.0 m -65.46 -38.8 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.538 -173.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -65.56 -32.99 74.88 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.074 0.464 . . . . 0.0 110.923 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 t -74.27 -24.53 59.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.594 0.758 . . . . 0.0 111.03 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -107.41 3.1 24.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.312 0.645 . . . . 0.0 111.469 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 75.7 m -63.76 -43.6 77.22 Favored Pre-proline 0 N--CA 1.487 1.393 0 CA-C-O 118.545 -0.741 . . . . 0.0 112.768 174.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -83.95 18.93 1.44 Allowed 'Trans proline' 0 C--N 1.38 2.222 0 CA-C-N 121.657 1.628 . . . . 0.0 113.02 175.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -118.79 96.63 5.34 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.09 0.956 . . . . 0.0 109.895 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -26.7 68.4 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.917 0.487 . . . . 0.0 110.199 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -45.88 -40.8 10.49 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.815 1.646 . . . . 0.0 112.513 171.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -90.06 -23.82 21.33 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.338 0.655 . . . . 0.0 111.253 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -70.41 118.41 13.19 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 120.649 0.262 . . . . 0.0 110.333 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -96.04 98.64 10.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -66.45 103.61 1.08 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -124.87 139.77 53.53 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.642 0.777 . . . . 0.0 109.731 -164.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -97.28 127.93 43.68 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.228 0.611 . . . . 0.0 110.083 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.28 150.67 40.1 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.887 0.875 . . . . 0.0 110.71 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 t -71.4 -8.17 52.08 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 121.313 0.578 . . . . 0.0 110.016 171.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.587 HD22 ' HG2' ' A' ' 99' ' ' MET . 62.0 m-20 -74.57 -3.74 32.84 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.557 1.143 . . . . 0.0 111.906 169.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.94 13.51 82.08 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 123.042 0.353 . . . . 0.0 112.625 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -110.64 178.42 4.37 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.208 1.003 . . . . 0.0 110.202 -177.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -126.3 127.77 46.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.69 0.396 . . . . 0.0 110.982 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.604 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 20.3 p90 -129.65 176.7 7.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.835 1.254 . . . . 0.0 108.688 174.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -133.54 150.35 51.67 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.768 0.318 . . . . 0.0 110.174 174.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.516 ' ND2' ' HE3' ' A' ' 87' ' ' LYS . 3.4 p-10 -133.41 124.08 26.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.52 129.23 34.88 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 123.816 0.847 . . . . 0.0 109.614 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.516 ' HE3' ' ND2' ' A' ' 85' ' ' ASN . 34.2 mmtp -99.82 162.01 13.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.298 1.039 . . . . 0.0 111.355 -178.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.43 179.52 4.25 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.183 -1.372 . . . . 0.0 109.413 173.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.36 -15.63 63.35 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.06 0.544 . . . . 0.0 111.128 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -96.9 16.49 19.2 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.661 0.784 . . . . 0.0 111.968 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 80.6 m80 64.24 9.5 4.86 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 124.433 1.093 . . . . 0.0 112.723 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -88.04 146.47 25.45 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.248 0.619 . . . . 0.0 110.508 -176.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.4 mt -82.88 100.57 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.9 pt -86.98 -13.1 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.829 177.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.462 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -153.11 149.83 21.47 Favored Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 176.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 p -158.32 128.54 6.07 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.479 0.711 . . . . 0.0 109.502 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.7 t -107.37 166.97 10.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.688 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -75.03 161.24 29.62 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.508 0.723 . . . . 0.0 110.724 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.604 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -74.7 118.67 17.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.381 0.61 . . . . 0.0 110.005 -178.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.51 148.44 27.21 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.316 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.33 71.79 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.956 0.902 . . . . 0.0 112.117 -177.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.3 p -128.94 162.68 27.0 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.483 0.713 . . . . 0.0 110.188 175.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -65.5 -36.09 82.81 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.139 172.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.0 -37.91 89.06 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.489 0.715 . . . . 0.0 111.503 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.0 t -67.92 -30.58 69.94 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.57 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -70.59 -38.21 74.0 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.865 0.466 . . . . 0.0 110.704 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 7.1 mm-40 -68.09 -28.9 67.74 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.127 0.571 . . . . 0.0 111.011 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.2 m -61.72 -45.95 91.75 Favored 'General case' 0 C--N 1.349 0.577 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.07 -34.84 91.01 Favored Glycine 0 C--N 1.349 1.285 0 CA-C-N 115.056 -0.974 . . . . 0.0 113.526 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 28.6 mm -60.05 -52.37 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.1 66.44 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.473 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.1 t -70.72 -50.07 40.2 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.248 0.619 . . . . 0.0 110.003 -178.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.55 -30.67 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 C-N-CA 123.504 0.721 . . . . 0.0 110.871 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 83.9 tttt -64.2 -35.02 79.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.432 0.693 . . . . 0.0 111.45 177.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -93.49 -36.17 12.58 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.663 0.785 . . . . 0.0 112.49 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -103.76 -8.56 19.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.096 0.958 . . . . 0.0 111.785 -168.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.61 -22.79 73.61 Favored Glycine 0 N--CA 1.472 1.041 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.131 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -84.06 -12.12 55.63 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.662 0.785 . . . . 0.0 111.354 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.8 m -69.42 101.59 1.59 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 109.888 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -82.86 18.95 1.45 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.272 0.629 . . . . 0.0 111.915 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.6 m -75.32 93.95 2.96 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.298 1.039 . . . . 0.0 109.353 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.62 139.32 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.662 0.785 . . . . 0.0 110.903 -172.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -118.91 115.36 24.21 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.351 1.06 . . . . 0.0 109.099 175.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.38 97.35 7.68 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 121.421 0.629 . . . . 0.0 111.142 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.59 -16.01 58.87 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.179 0.992 . . . . 0.0 111.312 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 CA--C 1.547 0.857 0 C-N-CA 124.553 1.141 . . . . 0.0 112.459 -175.629 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.265 0 N-CA-C 113.526 0.17 . . . . 0.0 113.526 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 38.3 p90 -119.51 160.3 22.66 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.916 0.887 . . . . 0.0 110.597 -173.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -86.95 153.31 21.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.976 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.438 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 86.6 mt-10 -132.86 121.21 22.57 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 167.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.28 98.16 5.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -99.33 163.04 12.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.84 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 17.2 ptpt -133.83 134.12 42.42 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 168.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.9 m -76.62 175.47 9.27 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.319 0.581 . . . . 0.0 110.896 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 t -67.5 -12.58 60.65 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.619 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -83.37 3.59 31.08 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.658 1.183 . . . . 0.0 112.219 175.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 m120 65.67 15.32 9.99 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.167 0.987 . . . . 0.0 111.923 -175.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HB2' HD12 ' A' ' 48' ' ' LEU . 15.0 mm100 -96.29 137.76 34.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.864 0.865 . . . . 0.0 109.914 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -90.55 144.22 25.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.034 0.534 . . . . 0.0 110.73 -175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -156.97 147.04 20.96 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 109.064 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -94.28 127.5 40.18 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.3 m -107.47 132.8 54.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.684 HD22 ' HB3' ' A' ' 116' ' ' ASN . 11.5 mt -99.24 112.24 24.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.395 0.678 . . . . 0.0 109.257 177.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -102.75 125.94 49.68 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.98 178.05 1.2 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 123.758 0.661 . . . . 0.0 111.097 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.91 -12.75 37.34 Favored Glycine 0 CA--C 1.541 1.685 0 N-CA-C 114.079 0.392 . . . . 0.0 114.079 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -85.2 -6.22 59.29 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.411 1.085 . . . . 0.0 112.017 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 14.32 81.9 Favored Glycine 0 N--CA 1.473 1.121 0 C-N-CA 122.727 0.204 . . . . 0.0 112.982 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -102.75 121.5 42.59 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.328 1.051 . . . . 0.0 109.764 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.1 m -66.21 120.97 14.17 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.074 0.55 . . . . 0.0 110.459 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.2 pt -99.93 -35.41 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 124.616 1.166 . . . . 0.0 110.366 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 20.4 tp -137.38 148.47 46.25 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.701 0.801 . . . . 0.0 109.926 -169.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.1 m -145.15 116.81 8.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.32 0.648 . . . . 0.0 109.506 175.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.5 t -65.44 157.72 28.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.087 0.955 . . . . 0.0 110.801 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.84 164.83 18.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.126 0.571 . . . . 0.0 111.153 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.5 mm? -70.65 127.92 34.33 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.167 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.452 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -107.7 142.68 37.32 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.119 0.968 . . . . 0.0 109.706 177.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.3 -22.5 63.79 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.368 0.667 . . . . 0.0 111.749 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.7 t -148.42 159.5 43.97 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.237 0.615 . . . . 0.0 111.483 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -27.96 68.3 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.786 0.835 . . . . 0.0 111.177 176.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.9 t -71.27 -32.51 68.79 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.912 0.485 . . . . 0.0 110.731 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.452 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 16.4 m -69.04 -40.87 78.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.492 0.717 . . . . 0.0 109.61 173.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.98 -31.67 72.39 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.355 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.83 -40.33 95.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.546 0.739 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -71.3 -34.37 70.55 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.525 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.45 98.29 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.637 -0.711 . . . . 0.0 113.14 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.6 tt -74.68 -37.73 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.741 0.27 . . . . 0.0 110.742 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.62 70.47 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.059 0.544 . . . . 0.0 110.267 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 m -71.53 -55.71 7.29 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.708 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 59' ' ' ILE . 33.7 m -59.61 -31.2 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-N 118.27 0.486 . . . . 0.0 111.758 -176.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -62.5 -47.85 82.12 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.54 1.136 . . . . 0.0 110.546 176.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.3 m -72.26 -26.1 61.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.025 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.496 ' ND2' ' HG2' ' A' ' 71' ' ' ARG . 4.3 m-20 -96.39 1.59 51.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.326 1.051 . . . . 0.0 111.794 -174.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.548 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 23.5 m -59.46 -50.27 88.08 Favored Pre-proline 0 CA--C 1.565 1.525 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.777 175.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -83.03 -5.78 11.29 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.824 1.682 . . . . 0.0 113.232 175.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -83.32 78.35 9.64 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.62 -30.22 71.36 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.925 0.89 . . . . 0.0 112.055 -175.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.18 -24.45 59.37 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.626 0.77 . . . . 0.0 111.195 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.496 ' HG2' ' ND2' ' A' ' 65' ' ' ASN . 3.4 tpm_? -75.79 -23.25 55.87 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.196 0.599 . . . . 0.0 110.661 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -70.55 120.56 16.36 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -101.36 108.3 19.88 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.482 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 135.58 33.49 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.665 0.386 . . . . 0.0 110.093 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -155.59 161.43 40.84 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 109.747 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.9 m -92.56 141.55 28.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.05 0.54 . . . . 0.0 109.814 176.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.69 158.0 28.45 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.712 0.805 . . . . 0.0 109.943 170.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.9 t -64.06 -23.79 67.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.307 0.643 . . . . 0.0 110.714 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -66.9 -18.44 65.38 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.876 0.871 . . . . 0.0 111.693 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.88 -7.9 42.12 Favored Glycine 0 C--N 1.349 1.271 0 C-N-CA 122.961 0.315 . . . . 0.0 113.591 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.529 ' HG3' ' HA ' ' A' ' 101' ' ' ALA . 0.0 OUTLIER -99.31 146.18 26.52 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.18 0.592 . . . . 0.0 110.734 -176.367 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -90.43 139.19 30.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.155 0.982 . . . . 0.0 110.415 -172.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -148.64 174.86 11.71 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.674 0.79 . . . . 0.0 109.268 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -131.14 138.74 49.6 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.458 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.547 HD22 HD13 ' A' ' 93' ' ' ILE . 11.5 m-20 -114.9 105.56 13.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.892 1.277 . . . . 0.0 108.904 172.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.7 OUTLIER -78.7 111.6 14.96 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 173.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -120.73 146.18 46.74 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 176.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.415 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -86.44 -173.88 4.74 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.443 0.697 . . . . 0.0 111.13 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.35 -28.1 67.91 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -95.9 24.42 5.49 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.096 0.558 . . . . 0.0 111.571 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.0 t60 72.3 -3.79 2.19 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -70.61 112.63 7.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.381 0.672 . . . . 0.0 109.93 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.547 HD13 HD22 ' A' ' 85' ' ' ASN . 57.0 mt -67.39 98.35 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 122.032 0.92 . . . . 0.0 109.071 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 21.3 pt -82.67 -6.68 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.144 -178.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -164.03 117.24 0.75 Allowed Glycine 0 C--N 1.345 1.034 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.5 t -116.12 114.86 25.07 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.903 0.881 . . . . 0.0 108.944 175.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.9 p -81.79 167.76 18.72 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.842 0.457 . . . . 0.0 111.283 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -77.23 164.31 25.72 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.226 177.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.8 ptp -73.58 123.5 24.1 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -102.31 122.08 43.54 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.77 0.828 . . . . 0.0 109.773 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.529 ' HA ' ' HG3' ' A' ' 81' ' ' LYS . . . -62.79 -40.72 98.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.816 0.846 . . . . 0.0 110.845 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.462 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 39.1 p -104.87 131.3 52.53 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.21 65.35 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.306 1.042 . . . . 0.0 111.828 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.462 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 10.8 pt20 -62.93 -37.43 87.0 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.024 0.53 . . . . 0.0 110.737 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 13.9 t -71.31 -28.53 64.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.383 0.673 . . . . 0.0 110.515 -177.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -67.36 -51.2 55.1 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.105 0.962 . . . . 0.0 109.87 177.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.96 -29.09 60.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.095 0.558 . . . . 0.0 111.948 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 98.0 m -67.57 -33.51 75.17 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.2 -30.12 76.56 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.171 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.3 mm -64.96 -49.39 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-O 121.368 0.604 . . . . 0.0 109.886 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.91 73.08 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.198 178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.2 t -71.13 -48.65 50.89 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.16 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.19 -27.12 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.448 0.699 . . . . 0.0 110.724 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 38.8 ttpt -66.59 -46.75 74.92 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 172.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.58 -33.66 69.24 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.906 0.883 . . . . 0.0 111.92 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.684 ' HB3' HD22 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -84.39 -30.99 24.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 0.0 110.01 -177.158 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.54 -41.17 58.27 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.5 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.1 p -80.47 -4.71 54.84 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.446 0.698 . . . . 0.0 111.713 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.8 t -75.77 -34.33 60.24 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.992 0.517 . . . . 0.0 109.835 173.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 67.75 -7.64 0.58 Allowed 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 125.37 1.468 . . . . 0.0 114.261 167.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 t -80.31 123.98 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.229 0.612 . . . . 0.0 110.768 -170.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 57.6 t -105.52 133.95 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 123.35 0.66 . . . . 0.0 111.303 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.438 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 43.1 tptt -110.45 141.76 43.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.11 1.364 . . . . 0.0 108.411 173.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -84.24 112.4 20.25 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -110.7 11.59 22.67 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.891 0.853 . . . . 0.0 109.687 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.455 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 21.7 p . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 124.255 1.022 . . . . 0.0 110.82 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.522 0.487 0 N-CA-C 114.011 0.364 . . . . 0.0 114.011 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -152.2 169.87 21.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.844 0.858 . . . . 0.0 109.958 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -109.98 127.15 54.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.347 1.059 . . . . 0.0 109.568 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -91.97 106.87 18.8 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 167.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 64.6 tp -85.52 98.5 10.66 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 176.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -113.37 177.92 4.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.937 0.895 . . . . 0.0 109.735 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -141.75 156.0 45.61 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.626 0.77 . . . . 0.0 109.935 175.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.6 m -89.86 178.69 6.17 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.126 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -66.65 -22.85 66.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.616 0.766 . . . . 0.0 110.801 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -91.11 15.36 11.86 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.415 0.686 . . . . 0.0 111.285 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 67.3 14.96 9.87 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.243 1.417 . . . . 0.0 112.75 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 16.0 mm100 -70.32 124.86 25.2 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.67 0.788 . . . . 0.0 110.997 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.84 118.68 24.64 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.809 0.844 . . . . 0.0 108.942 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -142.49 118.99 10.95 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.92 0.888 . . . . 0.0 109.093 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -94.04 132.03 38.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.603 HG12 HG23 ' A' ' 45' ' ' THR . 23.2 m -107.45 133.97 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 171.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.9 tp -90.0 120.79 31.51 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -106.8 153.95 21.72 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.692 1.197 . . . . 0.0 109.653 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.19 177.66 8.88 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.775 168.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.34 -23.53 62.43 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.449 173.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -67.35 -18.89 65.33 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.766 1.227 . . . . 0.0 111.769 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.89 -7.82 80.66 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.796 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.05 136.23 36.53 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.286 0.634 . . . . 0.0 109.712 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.0 m -73.15 120.84 19.33 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.342 0.591 . . . . 0.0 109.779 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.534 HD11 ' HG ' ' A' ' 35' ' ' LEU . 22.0 pt -103.74 -16.52 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.606 1.162 . . . . 0.0 111.245 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.7 tp -157.8 141.7 15.79 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.603 HG23 HG12 ' A' ' 34' ' ' VAL . 53.3 m -133.16 113.45 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.242 0.617 . . . . 0.0 109.652 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -69.5 164.82 22.3 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.964 0.506 . . . . 0.0 110.799 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -75.92 166.01 24.14 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.399 0.619 . . . . 0.0 111.601 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.86 114.18 15.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.642 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -100.37 145.57 28.02 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.587 0.755 . . . . 0.0 109.17 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -90.15 -2.13 58.03 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 120.988 0.423 . . . . 0.0 111.099 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.439 ' HB3' HG22 ' A' ' 53' ' ' THR . 50.8 m -142.03 137.25 30.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.507 0.723 . . . . 0.0 110.549 -177.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -28.24 69.78 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.939 0.895 . . . . 0.0 111.64 178.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.439 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -63.22 -33.72 76.11 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.459 0.704 . . . . 0.0 111.156 178.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 m -76.56 -31.65 57.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.632 0.773 . . . . 0.0 110.466 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.19 -32.39 66.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.507 0.723 . . . . 0.0 110.752 173.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -67.4 -49.11 65.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.959 0.904 . . . . 0.0 110.37 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.63 -36.57 84.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.617 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.6 -48.51 85.84 Favored Glycine 0 C--N 1.345 1.049 0 O-C-N 124.124 0.89 . . . . 0.0 112.563 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.544 ' HA ' HG22 ' A' ' 62' ' ' VAL . 15.9 tt -74.64 -31.48 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 116.608 0.204 . . . . 0.0 111.146 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.68 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.972 0.509 . . . . 0.0 110.331 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.0 m -73.37 -47.71 40.0 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.13 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -62.3 -35.29 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 118.654 0.661 . . . . 0.0 110.741 -177.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.713 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 12.2 ttp180 -66.25 -45.52 80.31 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.173 0.989 . . . . 0.0 110.357 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -67.92 -28.37 67.43 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.784 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.487 ' HB3' HD11 ' A' ' 86' ' ' LEU . 16.0 m120 -100.94 3.53 41.77 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.135 0.974 . . . . 0.0 111.777 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.0 m -63.11 -52.25 63.92 Favored Pre-proline 0 CA--C 1.56 1.346 0 CA-C-O 118.648 -0.691 . . . . 0.0 110.831 172.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.49 -19.46 42.82 Favored 'Trans proline' 0 C--N 1.4 3.238 0 C-N-CA 121.642 1.561 . . . . 0.0 111.65 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 -81.73 77.21 8.6 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 121.944 0.878 . . . . 0.0 109.542 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -66.95 -21.17 65.99 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.166 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -74.43 -31.69 62.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.717 0.807 . . . . 0.0 110.603 174.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -76.51 -25.5 54.25 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.324 0.65 . . . . 0.0 111.74 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.654 ' HE1' HG23 ' A' ' 110' ' ' ILE . 8.3 p90 -107.53 132.96 52.68 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 121.133 0.492 . . . . 0.0 110.407 172.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -97.31 117.11 30.79 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.064 -174.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB2' ' HD2' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -71.77 104.08 3.31 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.214 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -119.71 151.73 38.29 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.23 1.012 . . . . 0.0 110.6 -169.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.0 m -106.17 124.64 49.91 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.351 0.66 . . . . 0.0 109.755 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 166.24 16.83 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.487 1.115 . . . . 0.0 112.046 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.9 p -64.87 -16.9 63.78 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.06 0.944 . . . . 0.0 112.112 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -90.36 9.71 27.86 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.056 0.943 . . . . 0.0 110.999 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.44 6.85 71.62 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 123.026 0.345 . . . . 0.0 113.758 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 48.2 mmtm -88.98 152.26 21.81 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.069 0.948 . . . . 0.0 110.499 -177.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.43 ' HB3' ' HB2' ' A' ' 106' ' ' ARG . 89.4 m-85 -109.74 126.52 53.82 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.378 0.671 . . . . 0.0 111.017 -170.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.667 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 16.5 p90 -143.97 178.85 7.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.68 1.192 . . . . 0.0 108.538 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.504 ' HE2' HG21 ' A' ' 113' ' ' VAL . 19.6 p90 -146.26 135.08 22.38 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.6 p-10 -116.04 146.12 42.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.487 HD11 ' HB3' ' A' ' 65' ' ' ASN . 25.3 tp -119.08 120.35 36.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.667 0.787 . . . . 0.0 109.982 -173.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -91.89 149.96 21.29 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.487 1.115 . . . . 0.0 110.985 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -107.69 176.15 5.25 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.354 1.062 . . . . 0.0 109.554 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.55 -28.2 66.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.56 0.744 . . . . 0.0 111.632 175.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -81.41 5.88 16.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.6 m80 66.24 13.12 9.01 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.685 1.194 . . . . 0.0 111.916 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.77 153.42 17.77 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 124.042 0.937 . . . . 0.0 109.874 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.5 mm -81.85 119.02 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.2 pt -98.17 -8.98 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.187 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.92 111.36 0.33 Allowed Glycine 0 C--N 1.347 1.159 0 O-C-N 123.452 0.47 . . . . 0.0 112.344 175.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 p -114.91 131.6 56.82 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.1 t -85.97 158.19 19.94 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 123.175 0.59 . . . . 0.0 110.261 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -78.41 149.08 33.39 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.667 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.0 ptt? -74.06 117.32 15.72 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.23 0.538 . . . . 0.0 110.662 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -89.45 160.08 16.96 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.602 1.161 . . . . 0.0 111.283 -176.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.448 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -75.84 -52.44 10.36 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.063 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 67.9 p -85.37 142.77 29.06 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.467 -171.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.48 -25.77 64.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.949 0.9 . . . . 0.0 111.191 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -68.56 -36.36 78.66 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 122.98 0.512 . . . . 0.0 110.505 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.2 t -67.96 -23.2 65.02 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.858 0.863 . . . . 0.0 111.309 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.478 ' O ' HG12 ' A' ' 110' ' ' ILE . 55.7 ttp180 -61.28 -56.84 15.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.365 0.666 . . . . 0.0 109.547 172.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -72.94 -32.97 65.64 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.901 0.88 . . . . 0.0 111.753 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.9 m -67.28 -36.09 80.85 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.42 -35.84 63.15 Favored Glycine 0 C--N 1.347 1.187 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.04 176.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.654 HG23 ' HE1' ' A' ' 72' ' ' TYR . 45.4 mm -57.06 -46.9 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.4 0.68 . . . . 0.0 109.419 172.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.95 -37.06 78.62 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.232 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t -67.26 -51.92 47.1 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.059 -174.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.504 HG21 ' HE2' ' A' ' 84' ' ' PHE . 79.6 t -64.9 -31.98 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 123.24 0.616 . . . . 0.0 111.27 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.87 -39.38 94.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.502 0.721 . . . . 0.0 112.026 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -92.51 -43.82 8.96 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.313 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.473 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 59.6 m-20 -83.98 -18.94 35.5 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.997 0.919 . . . . 0.0 111.746 -171.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.8 -27.75 64.25 Favored Glycine 0 C--N 1.341 0.808 0 O-C-N 123.168 0.292 . . . . 0.0 112.886 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 48.1 p -75.17 -7.83 54.9 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 87.7 p -68.98 -44.22 73.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.379 0.672 . . . . 0.0 111.308 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.471 ' HB2' ' HD3' ' A' ' 63' ' ' ARG . 43.6 tt0 61.9 13.78 5.82 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.028 1.331 . . . . 0.0 111.947 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 m -81.46 89.2 6.13 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.672 -0.643 . . . . 0.0 111.107 -169.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 10.4 m -85.48 112.3 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-O 121.601 0.715 . . . . 0.0 111.728 -176.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -83.03 102.78 11.99 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 164.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -72.04 95.31 1.59 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.464 1.126 . . . . 0.0 109.826 -177.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -90.7 6.31 44.55 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.604 176.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 p . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 124.592 1.157 . . . . 0.0 110.817 173.625 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.452 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.525 0.708 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -159.75 164.67 33.64 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.913 0.885 . . . . 0.0 110.272 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -104.47 154.41 19.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.024 0.93 . . . . 0.0 109.643 172.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.8 mt-10 -136.39 117.89 14.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.084 0.954 . . . . 0.0 109.238 169.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.567 HD21 ' HB2' ' A' ' 52' ' ' LYS . 64.2 tp -81.0 107.1 13.52 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 175.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.9 p -126.85 136.66 52.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.502 0.721 . . . . 0.0 110.946 -170.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -94.66 137.71 33.42 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.696 0.798 . . . . 0.0 108.855 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -93.91 -176.51 4.05 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.766 0.826 . . . . 0.0 111.432 -177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -67.6 -16.33 64.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.029 0.532 . . . . 0.0 110.559 174.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -68.85 -12.78 61.91 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.161 0.984 . . . . 0.0 112.072 174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.409 HD22 ' N ' ' A' ' 29' ' ' ASN . 0.8 OUTLIER 69.87 13.26 8.0 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.603 1.161 . . . . 0.0 110.493 -171.498 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.541 ' HB2' HD12 ' A' ' 48' ' ' LEU . 14.7 mm-40 -108.22 150.62 27.03 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.111 0.964 . . . . 0.0 110.123 -176.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -100.88 128.92 46.71 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.027 0.931 . . . . 0.0 110.585 -169.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.0 ptt85 -143.79 139.63 29.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.617 0.767 . . . . 0.0 109.056 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -94.97 137.09 34.48 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.87 132.33 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 175.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -97.97 114.94 27.19 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -103.69 153.16 20.97 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.597 1.159 . . . . 0.0 110.375 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.8 -175.36 4.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.318 1.047 . . . . 0.0 110.234 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.56 -29.77 72.76 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 113.96 0.344 . . . . 0.0 113.96 -178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -72.58 -21.32 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.026 0.93 . . . . 0.0 111.086 176.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 7.5 59.5 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.204 -173.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -81.39 121.84 26.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.627 0.771 . . . . 0.0 109.748 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 m -70.08 121.64 17.86 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 122.914 0.485 . . . . 0.0 109.905 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.8 pt -100.06 -23.43 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.892 1.277 . . . . 0.0 110.74 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 18.8 tp -145.55 139.64 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.59 0.756 . . . . 0.0 109.574 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.3 m -135.91 125.2 24.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.508 0.723 . . . . 0.0 109.158 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -78.85 170.31 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.554 0.342 . . . . 0.0 110.99 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -74.38 161.64 29.65 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.522 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.8 mm? -68.75 111.6 4.96 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.038 174.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' A' ' 94' ' ' ILE . 79.3 m-85 -98.1 151.08 20.75 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.869 0.867 . . . . 0.0 109.992 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.35 -22.47 63.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.357 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.3 t -142.54 153.2 43.36 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.382 0.673 . . . . 0.0 110.705 -176.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HB2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -69.27 -27.22 65.23 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.654 175.451 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.7 p -60.81 -40.28 92.15 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.824 0.703 . . . . 0.0 110.659 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -65.43 -33.83 76.88 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.241 1.016 . . . . 0.0 111.347 177.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.24 -29.18 60.16 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.218 0.607 . . . . 0.0 111.402 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -74.32 -33.51 63.2 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.624 0.77 . . . . 0.0 110.24 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.5 -34.22 75.51 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.477 169.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -49.87 73.86 Favored Glycine 0 C--N 1.349 1.271 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.714 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.488 ' HA ' HG22 ' A' ' 62' ' ' VAL . 8.0 tt -69.07 -35.56 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 117.037 0.419 . . . . 0.0 110.903 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -36.29 74.66 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.211 0.529 . . . . 0.0 110.289 175.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.9 m -75.76 -44.43 41.63 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.593 177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.9 m -62.95 -32.42 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-N 119.381 0.991 . . . . 0.0 110.299 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.806 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -68.03 -50.58 54.47 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.383 1.073 . . . . 0.0 109.084 177.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.2 t -63.75 -31.52 72.73 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.093 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -107.5 16.57 23.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.133 0.973 . . . . 0.0 111.898 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -60.13 -52.68 71.64 Favored Pre-proline 0 CA--C 1.566 1.573 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.041 169.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -77.31 -6.13 16.2 Favored 'Trans proline' 0 C--N 1.399 3.226 0 C-N-CA 121.91 1.74 . . . . 0.0 112.435 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -96.22 82.33 3.43 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.69 -24.24 67.54 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.881 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -59.66 -29.99 68.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.885 0.874 . . . . 0.0 111.41 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -24.04 53.78 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.197 0.599 . . . . 0.0 111.384 -175.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -80.41 105.54 11.74 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -96.8 108.9 21.65 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.14 0.576 . . . . 0.0 109.856 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -78.26 117.55 19.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.387 0.675 . . . . 0.0 109.888 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -119.73 142.29 48.66 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.98 0.912 . . . . 0.0 110.398 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.4 m -94.76 111.29 23.08 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.22 154.62 12.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.236 1.014 . . . . 0.0 112.057 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.1 t -63.0 -17.45 62.18 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.024 0.93 . . . . 0.0 111.164 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.38 3.99 11.92 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.709 1.203 . . . . 0.0 111.839 174.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.77 0.06 87.31 Favored Glycine 0 C--N 1.354 1.535 0 C-N-CA 123.276 0.465 . . . . 0.0 112.778 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -87.73 165.29 15.47 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.029 0.931 . . . . 0.0 111.266 -172.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -113.82 129.17 56.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.366 0.666 . . . . 0.0 110.103 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -143.63 176.51 9.16 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.5 p90 -141.87 138.07 31.86 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 122.745 0.418 . . . . 0.0 110.212 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -99.31 166.94 10.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 169.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.621 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -135.1 121.3 20.15 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 -176.255 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -95.53 173.61 7.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.268 0.627 . . . . 0.0 111.864 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -135.87 174.28 10.79 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.67 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.26 -28.4 69.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.021 0.928 . . . . 0.0 111.386 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -85.97 6.9 26.57 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.556 0.742 . . . . 0.0 111.139 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 69.75 7.21 6.11 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.533 1.133 . . . . 0.0 111.606 -178.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.85 143.1 30.13 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.429 0.692 . . . . 0.0 110.678 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.8 mt -80.5 109.93 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.621 HD11 HD22 ' A' ' 86' ' ' LEU . 23.8 pt -91.42 -1.61 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 124.059 0.944 . . . . 0.0 112.26 -177.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.42 147.76 9.41 Favored Glycine 0 C--O 1.221 -0.695 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.6 p -154.81 129.07 8.98 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.675 0.79 . . . . 0.0 109.198 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.4 t -81.89 161.65 23.06 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -83.78 -78.43 0.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.796 0.438 . . . . 0.0 110.5 -171.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -168.22 121.67 0.89 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.225 0.61 . . . . 0.0 109.806 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -104.02 127.63 51.58 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.598 0.759 . . . . 0.0 109.68 173.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.37 -57.12 7.18 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.223 0.609 . . . . 0.0 109.702 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.498 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 38.8 p -85.5 125.57 33.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.703 174.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.7 -16.1 63.97 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.595 0.758 . . . . 0.0 112.276 -176.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.498 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 12.7 pt20 -65.17 -31.22 72.29 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.438 0.695 . . . . 0.0 110.977 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 m -72.79 -23.38 60.79 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.649 0.78 . . . . 0.0 111.085 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 110' ' ' ILE . 6.3 tmm_? -71.85 -40.72 68.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.66 0.784 . . . . 0.0 108.97 173.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.53 -50.49 71.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.805 0.842 . . . . 0.0 110.596 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.8 m -65.49 -29.97 70.68 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.208 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.9 -44.79 95.54 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.402 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 106' ' ' ARG . 37.3 mm -56.43 -49.18 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.401 0.68 . . . . 0.0 109.791 176.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.43 -36.25 82.34 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.793 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -72.1 -42.21 66.39 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.693 0.797 . . . . 0.0 110.52 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 71.0 t -70.19 -32.8 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.605 0.762 . . . . 0.0 110.76 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -67.46 -43.14 81.81 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.114 0.565 . . . . 0.0 110.572 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.15 -45.37 66.93 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.929 0.892 . . . . 0.0 111.47 -177.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.468 ' HB3' HD11 ' A' ' 35' ' ' LEU . 22.4 m120 -93.88 -1.85 54.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.2 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.62 -29.62 65.37 Favored Glycine 0 C--N 1.343 0.922 0 N-CA-C 111.996 -0.441 . . . . 0.0 111.996 174.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.806 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 14.7 t -88.63 5.71 41.71 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.803 0.841 . . . . 0.0 111.664 177.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.4 m -82.59 109.28 16.64 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.109 0.564 . . . . 0.0 109.695 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -86.5 74.63 9.88 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 122.031 0.92 . . . . 0.0 108.781 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.0 m -147.12 94.72 2.45 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.094 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 m -105.28 140.32 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.514 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 28.9 mtmm -107.76 117.63 34.62 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 170.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.83 94.59 1.06 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 175.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.42 -18.8 40.6 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.678 178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.549 0.937 0 C-N-CA 124.335 1.054 . . . . 0.0 110.827 174.865 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.569 0 N-CA-C 111.99 -0.444 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -130.94 151.32 51.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.526 0.73 . . . . 0.0 110.742 -175.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -90.26 155.02 19.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.543 168.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.592 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 41.3 mt-10 -132.46 124.5 28.7 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 31' ' ' PHE . 37.4 tp -79.7 99.5 7.44 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 p -106.57 156.85 18.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.28 1.432 . . . . 0.0 109.139 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.519 ' HB3' HG22 ' A' ' 126' ' ' THR . 21.6 ptmt -118.31 160.81 20.98 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.511 0.725 . . . . 0.0 109.869 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.3 t -120.39 177.81 4.89 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.457 0.703 . . . . 0.0 109.457 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -71.68 -8.52 54.65 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.142 0.577 . . . . 0.0 111.1 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.73 -4.2 33.06 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.201 1.0 . . . . 0.0 111.589 170.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 40.2 t-20 77.69 -12.94 1.01 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 125.614 1.565 . . . . 0.0 110.724 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -83.5 156.62 22.75 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.218 1.007 . . . . 0.0 112.111 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.517 ' HB3' HD11 ' A' ' 23' ' ' LEU . 27.0 m-85 -97.7 151.55 20.02 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.172 -175.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -156.95 155.88 32.08 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.627 0.771 . . . . 0.0 109.442 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -102.3 131.53 48.82 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.017 0.527 . . . . 0.0 109.767 173.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.56 130.55 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.37 108.75 21.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -177.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -97.87 130.69 44.76 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.84 178.06 1.47 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.182 0.593 . . . . 0.0 110.806 172.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.58 -18.14 55.41 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-O 121.025 0.236 . . . . 0.0 113.261 174.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -74.21 -14.38 60.93 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 111.578 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.35 12.75 80.08 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.649 -172.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -98.38 124.31 42.98 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.529 0.732 . . . . 0.0 110.568 -175.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.6 m -70.48 121.51 17.91 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.1 pt -109.44 -34.75 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.038 0.935 . . . . 0.0 110.499 -178.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.7 tp -137.02 151.2 48.69 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -145.98 112.99 6.1 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.414 0.686 . . . . 0.0 110.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.4 m -58.39 156.18 10.65 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.983 0.913 . . . . 0.0 111.178 173.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.457 ' CG ' ' HB ' ' A' ' 93' ' ' ILE . 23.1 mm-40 -66.91 169.22 8.5 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.266 0.555 . . . . 0.0 111.917 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.34 111.95 11.14 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.612 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.483 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 63.8 m-85 -104.7 132.92 50.37 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.58 1.552 . . . . 0.0 109.31 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.6 p -62.07 -34.73 76.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.145 0.978 . . . . 0.0 111.589 -175.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m -122.45 152.82 39.88 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.57 1.148 . . . . 0.0 109.563 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -27.3 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.809 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.8 t -72.09 -28.23 63.16 Favored 'General case' 0 C--N 1.36 1.048 0 O-C-N 123.56 0.538 . . . . 0.0 111.35 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.483 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.3 m -71.38 -33.07 69.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.424 0.63 . . . . 0.0 109.79 174.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.21 -34.24 59.26 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.649 172.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -67.4 -42.69 82.9 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.423 1.089 . . . . 0.0 110.918 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.085 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.68 -49.84 74.17 Favored Glycine 0 C--N 1.356 1.662 0 O-C-N 123.987 0.805 . . . . 0.0 112.695 177.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -70.23 -35.86 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 122.196 0.198 . . . . 0.0 111.066 177.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.64 75.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.856 0.462 . . . . 0.0 110.746 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.9 m -76.0 -41.4 51.25 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.858 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -66.03 -30.82 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-N 119.028 0.831 . . . . 0.0 110.355 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -64.07 -39.63 94.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.139 1.375 . . . . 0.0 111.091 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 t -89.25 -28.49 19.89 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.315 0.646 . . . . 0.0 111.314 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -97.22 3.39 51.44 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.181 0.592 . . . . 0.0 112.076 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.643 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 11.7 p -69.43 -40.66 15.1 Favored Pre-proline 0 CA--C 1.568 1.66 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.854 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.48 -39.32 28.98 Favored 'Trans proline' 0 C--N 1.402 3.347 0 CA-C-N 121.484 1.566 . . . . 0.0 111.384 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -79.97 80.52 6.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.928 0.891 . . . . 0.0 110.235 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 12.4 pt-20 -68.13 -8.17 36.09 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.314 0.578 . . . . 0.0 111.868 174.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.64 -35.82 22.53 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.949 1.7 . . . . 0.0 112.217 165.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -85.28 -8.72 58.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.554 0.742 . . . . 0.0 112.41 -172.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -88.15 123.37 32.73 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.827 0.851 . . . . 0.0 109.179 177.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.7 96.79 9.23 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 170.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -85.58 121.53 28.4 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.556 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -145.23 142.5 29.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.457 0.703 . . . . 0.0 109.983 -173.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.6 m -99.82 130.05 45.98 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.145 0.578 . . . . 0.0 109.527 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.25 170.27 10.55 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.68 1.192 . . . . 0.0 111.845 178.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 m -64.55 -30.06 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.717 0.807 . . . . 0.0 111.464 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -72.77 -11.69 60.71 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.331 0.653 . . . . 0.0 112.146 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.17 18.4 53.56 Favored Glycine 0 C--N 1.344 0.996 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.558 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.5 mmtp -84.88 121.82 28.29 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.309 0.644 . . . . 0.0 110.222 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 100' ' ' TYR . 73.8 m-85 -80.76 133.96 35.74 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.431 0.692 . . . . 0.0 109.76 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -152.22 173.66 14.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.458 0.647 . . . . 0.0 110.202 173.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -147.16 142.57 27.46 Favored 'General case' 0 C--O 1.246 0.912 0 C-N-CA 124.89 1.276 . . . . 0.0 108.213 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -117.18 110.6 18.35 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 174.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.677 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -77.9 128.03 33.3 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 178.759 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.592 ' HE2' HG12 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -113.55 145.45 41.21 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.788 0.835 . . . . 0.0 110.126 -171.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.79 170.64 10.25 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.958 0.903 . . . . 0.0 109.613 171.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.98 61.27 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.156 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.13 2.56 56.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.092 0.957 . . . . 0.0 111.512 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 67.8 17.58 9.74 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.797 1.239 . . . . 0.0 112.439 -175.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -79.34 126.65 31.08 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.592 HG12 ' HE2' ' A' ' 87' ' ' LYS . 39.8 mt -73.58 96.87 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.677 HD11 HD22 ' A' ' 86' ' ' LEU . 13.9 pt -79.95 -13.33 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.86 -175.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -158.73 129.91 2.38 Favored Glycine 0 C--O 1.218 -0.853 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 173.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.3 t -134.2 112.43 11.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.8 p -71.0 140.42 50.81 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -77.12 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 124.277 0.986 . . . . 0.0 110.11 -168.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 20.8 ptp -171.61 134.67 0.84 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.258 1.023 . . . . 0.0 108.732 168.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.466 ' HB2' ' HB2' ' A' ' 82' ' ' PHE . 24.0 m-85 -105.13 136.65 44.24 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.062 0.945 . . . . 0.0 110.258 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -92.33 -24.83 18.8 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.114 0.566 . . . . 0.0 110.618 174.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.468 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 74.0 p -115.07 132.53 56.57 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.66 0.784 . . . . 0.0 110.049 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.05 -20.28 29.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.578 0.751 . . . . 0.0 110.941 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.468 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 14.0 pt20 -67.23 -33.77 76.07 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.861 0.864 . . . . 0.0 111.886 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.518 ' HB2' ' NH1' ' A' ' 106' ' ' ARG . 20.6 m -72.88 -18.46 61.42 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.111 0.564 . . . . 0.0 111.71 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.518 ' NH1' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER -59.99 -26.93 66.44 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.342 1.057 . . . . 0.0 112.473 178.416 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.5 -49.4 77.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.521 0.728 . . . . 0.0 110.472 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.5 m -76.23 -35.02 59.21 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.852 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.466 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -64.57 -51.94 47.55 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.874 -173.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.3 mm -59.17 -41.65 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 123.919 0.888 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.11 90.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.107 0.563 . . . . 0.0 110.967 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.3 t -73.77 -30.26 62.67 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.43 0.692 . . . . 0.0 111.721 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 109' ' ' GLY . 79.5 t -74.22 -35.5 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 122.567 0.347 . . . . 0.0 110.102 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 66' ' ' SER . 68.7 mttm -70.65 -48.1 56.63 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.474 0.31 . . . . 0.0 111.089 174.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.49 -51.14 31.05 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.59 0.756 . . . . 0.0 111.967 -174.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -95.92 -7.47 36.57 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.182 0.593 . . . . 0.0 111.483 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.27 -21.08 71.02 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.084 0.24 . . . . 0.0 112.873 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.9 p -81.74 -1.45 47.13 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.372 0.669 . . . . 0.0 111.748 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.2 m -75.25 135.48 40.97 Favored 'General case' 0 C--N 1.348 0.541 0 C-N-CA 122.711 0.404 . . . . 0.0 110.941 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -3.28 58.07 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.306 0.642 . . . . 0.0 110.47 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 35.3 m -65.86 101.93 0.71 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.215 1.006 . . . . 0.0 110.847 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 16.0 m -117.91 142.12 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.592 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 14.2 tmtt? -122.09 139.69 53.41 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.01 124.09 27.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.394 0.616 . . . . 0.0 111.659 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -132.63 -18.8 2.42 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.614 0.766 . . . . 0.0 109.944 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.519 HG22 ' HB3' ' A' ' 25' ' ' LYS . 8.4 p . . . . . 0 C--N 1.36 1.062 0 C-N-CA 124.659 1.184 . . . . 0.0 111.004 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.513 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . . . . . . 0 C--O 1.236 0.271 0 N-CA-C 113.326 0.09 . . . . 0.0 113.326 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 31.7 p90 -137.49 148.65 46.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.063 0.945 . . . . 0.0 110.058 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -91.67 147.23 23.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.208 1.003 . . . . 0.0 108.859 170.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.549 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 42.9 mt-10 -133.75 116.37 15.67 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.471 0.709 . . . . 0.0 109.446 175.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' A' ' 31' ' ' PHE . 32.6 tp -83.25 99.51 10.02 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.381 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.9 p -108.84 147.59 31.88 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.329 1.052 . . . . 0.0 109.31 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' HG3' HG22 ' A' ' 126' ' ' THR . 9.9 mtmp? -95.78 143.69 26.8 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 173.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.5 p -86.73 -172.34 3.96 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.209 1.003 . . . . 0.0 111.159 -176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.27 -19.85 64.74 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 122.803 0.441 . . . . 0.0 110.437 171.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -84.11 -1.09 54.32 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.016 0.927 . . . . 0.0 111.948 174.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.5 t30 69.96 9.77 7.22 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 124.73 1.212 . . . . 0.0 110.702 -175.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -88.3 154.4 20.44 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.589 0.756 . . . . 0.0 111.448 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.581 ' HB3' HD11 ' A' ' 23' ' ' LEU . 94.4 m-85 -89.79 125.15 35.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.247 1.019 . . . . 0.0 110.568 -171.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -137.56 130.33 30.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.922 1.289 . . . . 0.0 108.936 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -91.3 132.48 36.12 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.138 0.575 . . . . 0.0 109.638 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.49 HG12 HG23 ' A' ' 45' ' ' THR . 25.8 m -113.71 131.05 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 167.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 26.0 tp -101.7 110.26 22.21 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 177.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 61.2 mttp -100.4 143.17 30.9 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.849 0.86 . . . . 0.0 108.89 172.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.26 173.44 4.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.209 0.604 . . . . 0.0 110.144 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.15 -19.04 61.16 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.638 -0.255 . . . . 0.0 112.992 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.04 -4.08 39.37 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.295 1.038 . . . . 0.0 112.362 175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.42 4.25 89.03 Favored Glycine 0 C--N 1.348 1.232 0 CA-C-O 120.891 0.162 . . . . 0.0 112.842 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -90.19 113.29 25.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.439 1.096 . . . . 0.0 109.24 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 22.1 m -61.84 129.52 41.34 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 122.837 0.455 . . . . 0.0 109.821 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.5 pt -115.8 -22.12 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 124.426 1.091 . . . . 0.0 110.581 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.4 tp -150.97 143.77 24.49 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.335 1.054 . . . . 0.0 108.319 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.49 HG23 HG12 ' A' ' 34' ' ' VAL . 96.3 m -139.55 112.15 7.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.6 0.76 . . . . 0.0 109.235 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.4 t -68.68 166.1 18.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.857 0.863 . . . . 0.0 110.542 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -89.27 -172.51 3.66 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.82 119.66 26.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.76 0.824 . . . . 0.0 110.984 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.0 m-85 -109.19 133.18 53.36 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.014 0.925 . . . . 0.0 108.95 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 70.3 p -61.04 -41.27 96.26 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.114 0.566 . . . . 0.0 110.972 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -119.73 148.48 43.36 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.321 1.048 . . . . 0.0 109.738 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 16.4 ptpt -68.31 -27.03 65.93 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.433 0.293 . . . . 0.0 110.948 177.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.1 p -55.71 -37.63 68.66 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.737 0.815 . . . . 0.0 111.311 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 12.6 m -70.29 -38.92 75.11 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.907 0.883 . . . . 0.0 110.448 174.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.59 -28.53 67.84 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.471 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 52' ' ' LYS . 67.3 mm-40 -68.35 -38.89 81.9 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.239 0.616 . . . . 0.0 109.916 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 -31.67 70.72 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.294 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -65.34 -49.15 62.69 Favored Glycine 0 C--N 1.344 0.99 0 O-C-N 123.975 0.797 . . . . 0.0 113.061 177.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.405 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.3 tt -72.52 -31.88 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 122.672 0.389 . . . . 0.0 110.977 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.9 85.4 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.673 0.389 . . . . 0.0 110.129 173.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.7 m -69.81 -47.15 63.88 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.836 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' GLY . 15.1 m -61.79 -34.22 61.44 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 CA-C-N 119.146 0.885 . . . . 0.0 111.618 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.29 -33.41 49.44 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 123.299 0.639 . . . . 0.0 109.727 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.7 t -75.18 -26.29 58.93 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.823 0.849 . . . . 0.0 111.097 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.18 0.63 43.76 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.266 1.026 . . . . 0.0 110.993 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.7 t -67.34 -40.0 24.1 Favored Pre-proline 0 CA--C 1.566 1.576 0 C-N-CA 123.007 0.523 . . . . 0.0 111.837 175.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -72.38 -23.85 20.06 Favored 'Trans proline' 0 C--N 1.39 2.723 0 C-N-CA 121.756 1.637 . . . . 0.0 113.229 166.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -79.94 90.87 5.36 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.914 0.485 . . . . 0.0 110.356 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 72' ' ' TYR . 11.6 pt-20 -64.93 -24.17 67.44 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.015 0.926 . . . . 0.0 111.776 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.29 -14.47 62.61 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.978 0.911 . . . . 0.0 112.557 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.436 ' HA ' ' HE ' ' A' ' 71' ' ' ARG . 7.7 mmp_? -91.14 -24.04 20.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.769 0.428 . . . . 0.0 110.762 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.422 ' HD2' ' HA ' ' A' ' 69' ' ' GLU . 89.6 m-85 -75.46 95.78 3.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.614 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -96.12 106.18 18.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.705 0.802 . . . . 0.0 109.857 -174.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.471 ' HB3' ' NE ' ' A' ' 106' ' ' ARG . 62.4 pttt -91.19 123.41 34.62 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.185 0.517 . . . . 0.0 111.223 -177.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.63 168.97 16.25 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.738 0.815 . . . . 0.0 109.494 175.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 7.4 m -100.4 112.65 25.02 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.23 163.05 1.23 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.464 1.106 . . . . 0.0 112.284 174.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 80.7 p -62.52 -20.26 64.44 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.373 0.669 . . . . 0.0 111.318 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -81.38 2.58 27.83 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.852 1.261 . . . . 0.0 111.882 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.33 19.3 79.64 Favored Glycine 0 C--N 1.353 1.49 0 C-N-CA 122.973 0.32 . . . . 0.0 113.455 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 99' ' ' MET . 73.3 mmtt -106.81 155.79 19.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.581 0.752 . . . . 0.0 110.125 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -104.76 128.85 53.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.878 0.471 . . . . 0.0 109.834 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.556 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 2.0 p90 -148.84 174.34 12.32 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.607 ' HB3' ' HE ' ' A' ' 106' ' ' ARG . 43.8 p90 -130.19 136.12 48.9 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.026 0.53 . . . . 0.0 111.805 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -103.45 115.37 30.41 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 170.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 24.0 tp -80.1 113.62 18.41 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 173.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.437 ' HE2' HG12 ' A' ' 93' ' ' ILE . 35.1 mmtp -97.39 164.11 12.59 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.005 0.922 . . . . 0.0 111.226 -175.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.79 175.27 5.55 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.253 1.021 . . . . 0.0 110.861 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.93 -26.07 65.79 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.131 0.972 . . . . 0.0 111.101 175.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -88.11 12.03 14.67 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.878 0.871 . . . . 0.0 110.946 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 65.2 15.77 10.19 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.821 1.248 . . . . 0.0 112.335 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -82.45 151.14 26.68 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.447 0.699 . . . . 0.0 110.13 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.437 HG12 ' HE2' ' A' ' 87' ' ' LYS . 46.9 mt -87.69 97.57 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.1 pt -85.45 -10.58 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.737 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -165.66 117.12 0.73 Allowed Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.6 p -103.89 113.95 27.85 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 169.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 37.5 t -73.66 166.54 23.09 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.203 0.525 . . . . 0.0 110.926 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -74.35 147.72 41.94 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.318 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.556 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.94 118.19 17.63 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -95.88 163.5 13.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.773 0.829 . . . . 0.0 110.666 -176.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.2 57.21 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.534 0.734 . . . . 0.0 111.253 -177.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.0 p -128.25 175.87 8.12 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.639 -178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.99 -20.52 61.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.025 0.93 . . . . 0.0 110.917 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -74.93 -42.76 57.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.832 0.853 . . . . 0.0 110.473 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.9 p -69.26 -22.11 63.85 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.822 0.449 . . . . 0.0 111.055 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.607 ' HE ' ' HB3' ' A' ' 84' ' ' PHE . 13.8 ttt180 -62.4 -41.81 98.96 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.626 0.37 . . . . 0.0 110.526 170.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -64.78 -36.1 83.24 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.256 0.622 . . . . 0.0 111.033 -177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.0 m -64.13 -36.85 85.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.881 171.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.88 -31.23 67.3 Favored Glycine 0 C--N 1.353 1.488 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.507 176.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.68 -49.57 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.93 -34.96 77.04 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.429 -1.259 . . . . 0.0 111.379 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t -69.1 -53.12 21.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.202 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.18 -31.56 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.628 0.771 . . . . 0.0 111.229 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -69.92 -50.5 41.5 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.362 0.665 . . . . 0.0 110.972 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.38 -19.25 36.42 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.394 0.678 . . . . 0.0 112.811 -173.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.513 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 91.0 m-20 -100.82 -30.77 11.51 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.647 0.779 . . . . 0.0 110.443 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.88 -17.26 77.53 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 116.089 -0.505 . . . . 0.0 113.62 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -71.18 -14.95 62.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.421 0.689 . . . . 0.0 111.65 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 98.2 p -65.68 -43.27 89.78 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 123.233 0.613 . . . . 0.0 110.223 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 59.25 19.78 7.89 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.705 1.202 . . . . 0.0 111.017 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.1 m -90.17 105.31 17.72 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.208 1.003 . . . . 0.0 109.457 -174.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.99 144.35 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 O-C-N 123.636 0.585 . . . . 0.0 110.895 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.549 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 25.8 mtpp -117.72 100.59 7.7 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 173.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.01 97.78 1.2 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.614 0.721 . . . . 0.0 109.49 -178.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.89 8.39 44.5 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.939 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.403 HG22 ' HG3' ' A' ' 25' ' ' LYS . 49.9 p . . . . . 0 CA--C 1.547 0.837 0 C-N-CA 123.193 0.597 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.312 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 36.1 p90 -154.81 167.14 31.24 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.831 0.852 . . . . 0.0 109.228 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -110.11 133.88 52.75 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.336 0.654 . . . . 0.0 110.035 177.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -98.77 106.13 18.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 165.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.27 128.74 34.96 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -147.02 166.41 26.92 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.823 0.449 . . . . 0.0 109.802 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -109.33 141.33 41.82 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.567 0.747 . . . . 0.0 109.189 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -86.49 -168.58 2.29 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.826 0.851 . . . . 0.0 111.306 -176.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.2 m -60.23 -27.29 67.08 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.614 0.765 . . . . 0.0 112.375 -179.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.449 ' HB3' ' HG2' ' A' ' 30' ' ' GLN . 19.4 t70 -102.23 14.55 31.64 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.844 0.857 . . . . 0.0 110.494 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 62.04 17.84 9.42 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.567 1.147 . . . . 0.0 112.088 -173.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.449 ' HG2' ' HB3' ' A' ' 28' ' ' ASP . 33.5 mm-40 -71.54 141.69 50.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.474 0.71 . . . . 0.0 110.058 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -90.77 115.72 28.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.401 0.681 . . . . 0.0 109.879 -165.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.419 ' HB2' HD23 ' A' ' 48' ' ' LEU . 8.3 tpp180 -140.37 120.46 13.74 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.654 1.182 . . . . 0.0 108.36 -172.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -109.33 138.26 45.96 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.428 0.291 . . . . 0.0 110.345 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.57 132.8 54.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 173.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 13.8 tp -88.39 119.33 28.71 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -105.64 140.15 39.15 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.376 1.071 . . . . 0.0 109.076 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.24 178.5 5.09 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.373 0.669 . . . . 0.0 110.824 173.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -67.51 -17.29 68.55 Favored Glycine 0 C--N 1.35 1.35 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 174.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -66.77 -23.52 66.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.781 0.833 . . . . 0.0 110.946 170.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.35 -7.39 68.92 Favored Glycine 0 C--N 1.349 1.27 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.443 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -90.35 138.75 31.28 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.102 0.961 . . . . 0.0 110.531 -174.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.1 m -69.48 123.93 22.56 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.539 0.736 . . . . 0.0 110.889 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.9 pt -111.86 -19.87 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.578 1.151 . . . . 0.0 111.007 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -156.01 154.91 31.81 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -173.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 96.5 m -155.86 129.19 8.23 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 125.184 1.394 . . . . 0.0 107.793 -176.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 83.2 p -72.75 -170.89 0.76 Allowed 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.677 0.671 . . . . 0.0 111.718 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -91.88 178.51 5.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.734 0.413 . . . . 0.0 110.833 165.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' ' 32' ' ' ARG . 72.8 mt -77.08 113.69 15.07 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.012 174.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -89.72 141.24 28.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.949 170.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 46.3 p -83.2 -11.61 57.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.176 0.59 . . . . 0.0 110.866 176.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.8 m -135.1 135.74 41.43 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.214 1.006 . . . . 0.0 110.285 177.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -28.16 69.61 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.871 0.868 . . . . 0.0 111.401 175.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.6 p -70.2 -31.66 69.22 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.453 0.701 . . . . 0.0 111.092 175.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -70.87 -27.99 64.24 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.611 0.364 . . . . 0.0 110.54 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.15 67.39 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.54 0.736 . . . . 0.0 111.355 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.405 ' HA ' HG22 ' A' ' 59' ' ' ILE . 0.3 OUTLIER -74.23 -29.37 61.68 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 176.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.15 -37.27 86.85 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 166.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.41 -48.91 78.74 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.009 0.818 . . . . 0.0 113.438 -178.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 56' ' ' GLU . 10.5 tt -66.68 -33.59 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 120.878 0.371 . . . . 0.0 110.751 177.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.74 81.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.12 0.568 . . . . 0.0 110.703 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.1 m -75.55 -42.04 53.38 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.438 0.695 . . . . 0.0 111.878 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.9 m -66.06 -32.1 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.51 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 51.5 ttp180 -65.43 -47.06 77.51 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.417 1.087 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.3 t -64.1 -26.4 68.53 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.141 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.557 HD22 HD11 ' A' ' 94' ' ' ILE . 87.5 m-20 -105.88 10.85 32.35 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.921 0.888 . . . . 0.0 112.511 -174.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.4 m -65.22 -46.87 72.26 Favored Pre-proline 0 CA--C 1.564 1.492 0 CA-C-O 118.525 -0.75 . . . . 0.0 112.054 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.79 -14.13 14.1 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.719 1.613 . . . . 0.0 112.763 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -80.12 94.62 6.02 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.276 0.63 . . . . 0.0 109.454 -177.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.04 -35.6 75.46 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.702 0.801 . . . . 0.0 111.881 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -61.5 -27.34 68.52 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.776 0.83 . . . . 0.0 111.71 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -87.57 -29.76 21.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -171.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.576 ' HB3' ' HG ' ' A' ' 86' ' ' LEU . 14.2 p90 -115.42 125.63 53.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 119.448 1.022 . . . . 0.0 109.161 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -137.91 137.76 38.35 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.515 0.726 . . . . 0.0 110.398 -173.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.455 ' HA ' ' HD1' ' A' ' 84' ' ' PHE . 2.3 ptmm? -76.62 105.12 7.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.251 171.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -91.35 164.68 13.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.707 1.203 . . . . 0.0 110.737 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -127.52 123.76 36.64 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.771 0.828 . . . . 0.0 108.885 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.12 165.54 20.11 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.435 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -60.48 -26.1 66.54 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.98 0.912 . . . . 0.0 111.46 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -84.37 -4.18 58.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.826 0.85 . . . . 0.0 111.636 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.02 62.12 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 122.91 0.291 . . . . 0.0 113.075 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 32.9 mmtp -71.98 129.94 39.76 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.269 0.627 . . . . 0.0 111.446 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -77.49 144.11 37.98 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.366 177.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -151.69 169.24 22.66 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 96' ' ' SER . 20.4 m-85 -105.25 160.13 15.33 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 122.12 -0.363 . . . . 0.0 110.079 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -140.23 103.78 4.67 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 168.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.576 ' HG ' ' HB3' ' A' ' 72' ' ' TYR . 1.4 tt -86.65 109.24 19.05 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -87.68 154.58 20.47 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.404 1.482 . . . . 0.0 110.655 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.46 166.3 10.65 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.55 1.14 . . . . 0.0 110.008 174.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -21.49 66.56 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.524 0.73 . . . . 0.0 111.661 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -86.09 10.69 13.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.123 0.969 . . . . 0.0 111.404 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.0 m80 62.85 25.29 15.01 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 177.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -115.08 156.77 24.58 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.212 1.005 . . . . 0.0 109.631 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.9 mt -87.72 121.28 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 122.818 0.447 . . . . 0.0 110.108 -176.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.557 HD11 HD22 ' A' ' 65' ' ' ASN . 17.6 pt -106.15 -4.95 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.071 0.948 . . . . 0.0 110.51 174.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -154.07 139.34 6.74 Favored Glycine 0 C--N 1.345 1.071 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 84' ' ' PHE . 77.8 p -159.47 169.72 23.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.221 1.408 . . . . 0.0 108.67 -177.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.4 t -132.87 165.39 24.74 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.553 -0.717 . . . . 0.0 110.537 174.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -72.5 -72.97 0.21 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.94 0.896 . . . . 0.0 109.454 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.562 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 22.5 ptp -175.87 139.87 0.41 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.301 1.04 . . . . 0.0 109.993 175.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -104.71 104.16 13.91 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.46 1.104 . . . . 0.0 108.863 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.58 -39.46 84.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.537 0.735 . . . . 0.0 110.893 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.7 p -90.01 133.6 34.72 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.857 173.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.1 -31.76 69.48 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.55 1.14 . . . . 0.0 112.673 -172.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.25 -28.58 68.83 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.458 0.703 . . . . 0.0 111.764 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 41.7 m -64.25 -22.44 66.95 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.882 0.873 . . . . 0.0 112.473 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.422 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.3 ptt180 -69.01 -39.56 79.22 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.37 -50.74 13.43 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.563 0.745 . . . . 0.0 110.103 -176.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.3 m -59.47 -38.35 80.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.994 0.918 . . . . 0.0 110.959 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.82 -35.66 92.18 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.252 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.429 HG23 ' HE2' ' A' ' 72' ' ' TYR . 26.4 mm -58.46 -48.3 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 CA-C-N 117.456 0.628 . . . . 0.0 110.852 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.64 -38.51 90.54 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.135 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -70.84 -42.96 69.47 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.01 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 70.5 t -65.78 -39.01 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.843 0.857 . . . . 0.0 110.391 179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -64.14 -39.46 94.06 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.674 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.23 -36.68 39.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.658 0.783 . . . . 0.0 112.59 -176.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.97 -8.84 17.38 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.074 0.55 . . . . 0.0 111.83 -169.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.04 -34.37 86.57 Favored Glycine 0 C--N 1.346 1.094 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.51 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 15.3 t -75.89 -5.75 47.56 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 124.01 0.924 . . . . 0.0 111.91 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.2 t -65.5 141.66 58.4 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.831 0.453 . . . . 0.0 109.808 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -121.44 8.2 10.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.342 1.057 . . . . 0.0 110.948 -172.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.2 t -97.04 115.84 28.18 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.39 131.33 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.825 0.85 . . . . 0.0 110.199 -178.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -92.32 110.28 21.67 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.631 0.772 . . . . 0.0 109.17 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -83.44 102.86 12.35 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.986 0.898 . . . . 0.0 110.159 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -91.77 -3.38 56.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.512 1.125 . . . . 0.0 110.21 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 27.0 p . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 124.034 0.933 . . . . 0.0 110.882 178.569 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 113.239 0.056 . . . . 0.0 113.239 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -153.05 150.61 29.34 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 123.873 0.869 . . . . 0.0 110.136 -178.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -87.05 143.46 27.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.213 177.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -129.71 111.72 12.93 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.0 tp -79.68 98.37 6.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.2 m -105.92 136.22 45.95 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.241 -170.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HB3' HG22 ' A' ' 126' ' ' THR . 19.4 ptmt -94.75 133.34 38.55 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 170.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 45.9 m -79.29 179.52 7.36 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.648 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.0 t -58.2 -37.98 75.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.046 0.538 . . . . 0.0 111.458 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -92.55 22.52 4.6 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 123.811 0.845 . . . . 0.0 110.77 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 64.31 19.59 11.85 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.513 1.125 . . . . 0.0 112.817 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.401 ' HB2' HD12 ' A' ' 48' ' ' LEU . 88.2 mm-40 -77.59 120.75 22.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.16 0.584 . . . . 0.0 109.692 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 49' ' ' TYR . 50.1 m-85 -89.52 124.2 34.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.645 0.778 . . . . 0.0 109.594 -170.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.605 ' HB2' ' HB2' ' A' ' 46' ' ' SER . 35.9 ptt180 -157.29 158.09 35.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.353 0.661 . . . . 0.0 109.877 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.51 ' HE2' HG23 ' A' ' 122' ' ' VAL . 16.7 m-85 -91.31 141.23 29.0 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.93 0.492 . . . . 0.0 109.805 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.409 HG12 HG23 ' A' ' 45' ' ' THR . 19.8 m -120.67 131.26 73.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 167.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -97.34 111.8 23.89 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -90.41 138.29 31.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.5 176.0 5.07 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.481 0.712 . . . . 0.0 110.135 169.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -60.19 -24.36 60.94 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 114.088 0.395 . . . . 0.0 114.088 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -81.26 0.4 36.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.291 1.037 . . . . 0.0 112.173 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.3 -0.71 89.55 Favored Glycine 0 C--N 1.353 1.512 0 C-N-CA 122.803 0.24 . . . . 0.0 113.599 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -88.21 130.56 35.04 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.455 0.702 . . . . 0.0 110.336 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.8 m -71.95 121.9 19.89 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.294 0.638 . . . . 0.0 110.287 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 pt -102.58 -32.08 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.452 1.101 . . . . 0.0 110.815 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 34.6 tp -132.18 149.45 52.39 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.993 0.917 . . . . 0.0 109.662 -172.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.409 HG23 HG12 ' A' ' 34' ' ' VAL . 91.6 m -152.99 125.77 8.35 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.411 1.084 . . . . 0.0 109.462 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.605 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 5.6 m -66.97 170.79 6.2 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.011 0.924 . . . . 0.0 110.583 175.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.1 168.11 20.62 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.7 mm? -71.3 112.48 7.47 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 84.9 m-85 -104.95 137.16 43.14 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 m -73.99 -28.74 61.61 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.161 0.505 . . . . 0.0 110.092 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.497 ' HB3' HG22 ' A' ' 53' ' ' THR . 17.6 m -105.32 132.59 51.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.624 0.77 . . . . 0.0 110.151 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -26.84 62.12 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.231 0.613 . . . . 0.0 111.316 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.497 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -62.09 -36.41 81.62 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.751 0.657 . . . . 0.0 110.89 174.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 m -65.83 -39.06 90.46 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 110.819 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.26 86.39 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.601 0.76 . . . . 0.0 110.455 174.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.64 -34.2 77.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.742 0.817 . . . . 0.0 110.839 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 53' ' ' THR . 64.1 mmtt -76.53 -30.33 57.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.28 -41.61 98.42 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 114.062 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -65.66 -42.32 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 117.112 0.456 . . . . 0.0 111.035 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.11 -36.28 83.79 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.967 0.507 . . . . 0.0 110.74 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.3 m -71.66 -46.03 60.16 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.695 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 33.6 m -67.15 -28.97 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 118.204 0.456 . . . . 0.0 110.8 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -69.21 -38.47 78.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.342 0.657 . . . . 0.0 110.491 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.5 t -76.31 -36.83 58.12 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.855 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -93.0 8.44 39.89 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.18 0.992 . . . . 0.0 111.465 -176.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.493 ' OG ' ' HA ' ' A' ' 114' ' ' LYS . 16.9 t -62.33 -44.94 89.73 Favored Pre-proline 0 CA--C 1.571 1.762 0 C-N-CA 124.709 1.203 . . . . 0.0 112.222 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.81 -6.73 6.62 Favored 'Trans proline' 0 C--N 1.393 2.904 0 C-N-CA 121.845 1.696 . . . . 0.0 113.479 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -83.89 85.75 7.27 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.99 0.516 . . . . 0.0 110.112 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.33 -23.3 67.35 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.864 0.866 . . . . 0.0 112.593 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -66.79 -34.9 78.84 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.649 0.78 . . . . 0.0 111.189 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -76.36 -20.9 56.75 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.11 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -73.21 116.21 13.48 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -96.24 98.38 10.26 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 147.43 38.82 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.946 0.403 . . . . 0.0 110.139 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -144.62 167.96 21.29 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.916 1.287 . . . . 0.0 109.129 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.4 m -126.73 114.73 18.37 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.278 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.11 154.7 5.33 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.855 1.262 . . . . 0.0 111.221 172.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 p -68.92 -12.94 62.11 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.631 0.772 . . . . 0.0 112.266 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -79.74 1.83 25.14 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.55 0.74 . . . . 0.0 111.948 170.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.48 10.59 84.3 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.172 0.295 . . . . 0.0 112.874 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -88.35 141.33 28.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.609 0.764 . . . . 0.0 110.154 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -101.77 128.56 48.05 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.964 0.506 . . . . 0.0 110.119 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.616 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 30.0 p90 -142.75 175.52 9.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -133.96 158.79 42.59 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 122.966 0.506 . . . . 0.0 110.153 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -127.05 100.72 6.24 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.505 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.27 111.54 18.44 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 173.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HE2' HG12 ' A' ' 93' ' ' ILE . 16.2 ptpt -127.93 155.37 44.32 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.558 0.343 . . . . 0.0 110.177 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.47 178.79 6.45 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.464 0.705 . . . . 0.0 110.692 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.28 -10.81 57.33 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.499 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.515 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 2.0 m-20 -80.86 5.4 16.17 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.295 1.038 . . . . 0.0 111.621 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 67.8 11.27 8.29 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.805 1.242 . . . . 0.0 111.976 -178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 4.0 pt20 -106.87 135.11 48.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.781 0.433 . . . . 0.0 110.955 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.422 HG12 ' HE2' ' A' ' 87' ' ' LYS . 55.9 mt -70.85 99.47 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 123.922 0.889 . . . . 0.0 110.131 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.505 HD11 HD22 ' A' ' 86' ' ' LEU . 18.3 pt -79.05 -12.91 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.313 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.44 146.54 9.58 Favored Glycine 0 C--O 1.215 -1.035 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.1 p -166.7 167.16 15.45 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 117.743 0.771 . . . . 0.0 109.772 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.2 t -113.75 165.25 12.74 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -76.78 -54.57 6.45 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.616 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 26.7 ptt? 174.33 131.52 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.75 1.62 . . . . 0.0 108.402 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.549 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 97.3 m-85 -98.28 156.87 16.51 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.072 0.549 . . . . 0.0 109.941 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.65 64.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.822 0.849 . . . . 0.0 111.213 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.5 p -130.39 177.1 7.59 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.54 0.736 . . . . 0.0 110.623 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.37 -28.56 65.21 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.845 172.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -61.82 -40.58 95.79 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.292 0.637 . . . . 0.0 110.572 172.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.549 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 14.6 m -68.55 -35.64 77.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.786 178.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -68.34 -46.14 70.99 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.969 0.508 . . . . 0.0 111.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.09 -28.59 65.53 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.779 0.432 . . . . 0.0 111.357 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 m -64.41 -40.58 96.06 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 168.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.68 99.63 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.785 175.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.9 mm -60.4 -48.88 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.714 0.805 . . . . 0.0 110.258 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.29 83.2 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.298 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.97 -37.55 61.9 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.695 -178.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.57 -30.69 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 123.288 0.635 . . . . 0.0 110.13 176.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HA ' ' OG ' ' A' ' 66' ' ' SER . 37.9 ttpt -70.23 -45.1 67.2 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 120.929 0.395 . . . . 0.0 110.81 172.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.69 -28.74 66.1 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.847 0.859 . . . . 0.0 111.924 -177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.78 -10.23 14.79 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.654 0.781 . . . . 0.0 111.415 -174.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.1 -23.79 75.22 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 112.024 -0.431 . . . . 0.0 112.024 175.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 25.4 p -78.45 -0.52 29.64 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.285 1.034 . . . . 0.0 112.406 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.6 t -70.85 135.69 48.23 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.482 0.713 . . . . 0.0 110.847 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -90.7 -16.48 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 110.335 175.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.5 m -73.98 93.16 2.19 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.752 0.821 . . . . 0.0 110.892 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . 0.51 HG23 ' HE2' ' A' ' 33' ' ' PHE . 2.0 p -96.63 132.99 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -126.23 106.6 9.65 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.899 0.88 . . . . 0.0 109.211 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.68 101.85 3.77 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.119 0.568 . . . . 0.0 110.86 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -76.26 -26.25 55.77 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 123.827 0.851 . . . . 0.0 109.977 169.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.52 HG22 ' HB3' ' A' ' 25' ' ' LYS . 31.3 p . . . . . 0 CA--C 1.544 0.729 0 C-N-CA 124.323 1.049 . . . . 0.0 110.95 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.424 0 CA-C-O 120.749 0.083 . . . . 0.0 113.257 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 29.5 p90 -141.08 148.75 40.65 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 123.319 0.647 . . . . 0.0 110.368 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.434 ' HB3' ' HD1' ' A' ' 33' ' ' PHE . 85.6 m-85 -98.41 120.29 38.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.943 175.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.443 ' HG2' ' HD3' ' A' ' 123' ' ' LYS . 44.5 mt-10 -92.62 114.09 26.55 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 173.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 31' ' ' PHE . 52.4 tp -80.61 96.63 6.91 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 172.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.7 p -105.04 148.54 26.66 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.134 1.373 . . . . 0.0 109.826 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -102.1 160.25 14.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.51 0.724 . . . . 0.0 111.13 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 96.5 p -89.94 -175.46 4.6 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 166.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.3 p -64.03 -20.21 65.75 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.082 0.553 . . . . 0.0 111.338 172.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -103.01 17.67 23.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.279 1.032 . . . . 0.0 111.339 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 64.74 16.48 10.43 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.841 1.257 . . . . 0.0 112.683 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -72.96 138.51 46.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.074 0.549 . . . . 0.0 110.066 -179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.523 ' HB3' HD11 ' A' ' 23' ' ' LEU . 77.7 m-85 -89.43 133.95 34.31 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.129 0.972 . . . . 0.0 110.159 -166.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB2' HD13 ' A' ' 48' ' ' LEU . 24.4 ttp180 -148.75 120.72 8.21 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -172.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HB3' ' A' ' 21' ' ' PHE . 23.5 m-85 -90.2 124.1 34.57 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.435 HG12 HG23 ' A' ' 45' ' ' THR . 35.4 m -111.18 131.71 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 21.7 tp -100.3 116.43 32.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 95.7 mttt -101.58 128.07 48.0 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 170.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.403 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.14 166.75 7.35 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.948 0.78 . . . . 0.0 111.349 175.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.57 -2.5 35.83 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-N 115.818 -0.628 . . . . 0.0 114.571 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -86.7 -14.0 43.78 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.505 0.722 . . . . 0.0 110.64 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.34 -5.64 41.55 Favored Glycine 0 C--N 1.351 1.405 0 C-N-CA 123.592 0.615 . . . . 0.0 113.758 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -97.46 139.86 32.76 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.295 0.638 . . . . 0.0 110.713 -176.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 20.5 m -67.41 143.81 56.1 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.044 0.938 . . . . 0.0 109.822 174.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.403 HD13 ' HB2' ' A' ' 37' ' ' ALA . 20.8 pt -132.43 -20.5 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.961 0.905 . . . . 0.0 111.362 -176.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -152.5 149.39 28.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.426 0.69 . . . . 0.0 109.498 -170.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.435 HG23 HG12 ' A' ' 34' ' ' VAL . 72.1 m -148.79 117.93 6.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.197 0.999 . . . . 0.0 109.273 177.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.8 t -79.33 172.49 13.72 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.391 0.676 . . . . 0.0 111.062 177.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.42 173.64 9.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.147 0.579 . . . . 0.0 111.649 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.4 mm? -82.83 111.36 18.66 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.482 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.6 m-85 -88.72 131.13 35.16 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.822 1.249 . . . . 0.0 109.164 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -66.49 -30.24 70.53 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.727 0.811 . . . . 0.0 111.414 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.6 m -125.52 143.97 50.76 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.709 0.804 . . . . 0.0 110.446 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.95 68.64 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.818 0.847 . . . . 0.0 111.017 175.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.5 p -62.05 -43.08 99.61 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.38 1.072 . . . . 0.0 110.793 176.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.482 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 8.3 m -65.52 -37.86 87.99 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.153 0.981 . . . . 0.0 110.073 178.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.9 -38.53 88.96 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.943 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.7 -39.66 94.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.08 0.552 . . . . 0.0 110.564 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.93 -37.52 86.26 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.575 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.4 76.36 Favored Glycine 0 C--N 1.35 1.334 0 O-C-N 123.878 0.736 . . . . 0.0 112.868 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.451 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.0 tt -72.04 -31.71 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 122.849 0.459 . . . . 0.0 111.118 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.42 87.24 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.99 0.516 . . . . 0.0 110.356 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.4 m -70.4 -52.14 24.51 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.955 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 59' ' ' ILE . 21.3 m -58.26 -33.05 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 122.585 0.354 . . . . 0.0 111.85 -173.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -66.99 -43.18 83.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.868 0.867 . . . . 0.0 110.799 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.6 t -69.59 -36.06 75.9 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.285 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.432 ' HB3' HD21 ' A' ' 86' ' ' LEU . 13.4 m120 -88.26 -0.42 57.1 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.027 0.931 . . . . 0.0 111.979 -174.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.656 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.5 m -55.03 -52.13 73.7 Favored Pre-proline 0 CA--C 1.565 1.534 0 C-N-CA 123.773 0.829 . . . . 0.0 112.425 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -81.26 -12.53 11.58 Favored 'Trans proline' 0 C--N 1.392 2.818 0 C-N-CA 121.914 1.743 . . . . 0.0 113.034 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -85.62 86.64 7.36 Favored 'General case' 0 C--N 1.351 0.646 0 C-N-CA 123.468 0.707 . . . . 0.0 109.979 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -62.54 -21.77 65.8 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.622 0.769 . . . . 0.0 111.459 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.539 ' HG3' ' HE ' ' A' ' 71' ' ' ARG . 11.7 tp10 -52.8 -36.28 58.11 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.319 1.448 . . . . 0.0 111.634 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HE ' ' HG3' ' A' ' 70' ' ' GLU . 5.1 mmp_? -90.27 0.77 57.07 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.58 0.752 . . . . 0.0 112.884 -174.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -99.48 134.13 42.8 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.911 0.484 . . . . 0.0 110.204 175.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 16.7 mm-40 -100.09 92.93 5.47 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.212 1.005 . . . . 0.0 108.363 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -89.1 101.36 14.02 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.745 0.783 . . . . 0.0 108.961 -176.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -136.16 173.22 11.95 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.698 0.799 . . . . 0.0 110.543 -170.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -120.98 128.01 52.32 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.744 0.817 . . . . 0.0 109.924 -176.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.0 160.43 32.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.726 0.811 . . . . 0.0 109.882 169.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.0 m -65.38 -10.96 37.7 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.196 0.598 . . . . 0.0 112.264 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -76.27 -5.18 45.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.038 0.935 . . . . 0.0 111.385 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.42 9.24 85.16 Favored Glycine 0 C--N 1.351 1.4 0 C-N-CA 123.306 0.479 . . . . 0.0 112.197 -174.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.426 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -97.22 132.81 42.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.242 0.617 . . . . 0.0 111.115 -173.313 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.659 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 62.4 m-85 -94.59 133.89 37.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.322 1.049 . . . . 0.0 110.597 -173.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -145.31 174.8 10.79 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.86 0.864 . . . . 0.0 109.245 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 24.9 p90 -138.69 134.26 33.39 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.277 0.631 . . . . 0.0 110.198 174.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.564 ' HB3' HD12 ' A' ' 93' ' ' ILE . 95.3 m-20 -110.04 120.6 42.96 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.574 0.75 . . . . 0.0 109.402 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.2 129.3 34.8 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -105.5 137.06 43.95 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.45 1.1 . . . . 0.0 110.448 -168.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.23 169.69 8.3 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.509 0.723 . . . . 0.0 110.082 173.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.59 -21.4 66.33 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.797 0.839 . . . . 0.0 111.904 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.411 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 11.5 m120 -85.79 4.67 35.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.811 0.844 . . . . 0.0 111.784 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.5 m170 70.73 -1.16 2.7 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.276 1.43 . . . . 0.0 112.82 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 30.0 pt20 -75.99 149.33 37.61 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 123.168 0.587 . . . . 0.0 110.467 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 85' ' ' ASN . 41.4 mm -87.37 99.59 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 12.5 pt -79.14 -4.79 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.83 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.16 94.16 0.1 OUTLIER Glycine 0 C--N 1.342 0.871 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.6 p -88.52 125.87 34.98 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.418 ' HB3' ' H ' ' A' ' 84' ' ' PHE . 38.3 t -79.27 169.99 17.29 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 121.675 0.75 . . . . 0.0 110.948 -178.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -74.41 150.91 39.78 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.119 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 16.5 ptm -76.55 116.5 17.29 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.436 ' HB3' ' OG ' ' A' ' 105' ' ' SER . 62.9 m-85 -102.91 153.16 20.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.856 0.862 . . . . 0.0 111.291 -173.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.85 -52.39 11.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.036 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.2 p -104.18 163.87 12.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.093 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.01 -27.51 61.82 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.05 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.5 -42.13 95.7 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.445 0.698 . . . . 0.0 111.278 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.436 ' OG ' ' HB3' ' A' ' 100' ' ' TYR . 34.5 p -73.29 -30.79 63.64 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.198 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.659 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 27.0 ptt180 -76.87 -36.3 56.86 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.07 0.395 . . . . 0.0 111.446 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.24 -29.87 60.35 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.884 0.373 . . . . 0.0 110.76 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.9 m -69.35 -33.88 73.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.53 167.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.22 -37.38 94.46 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.535 173.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.9 mm -59.82 -48.34 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 174.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.47 -36.23 79.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.361 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -71.25 -52.13 20.68 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.154 0.582 . . . . 0.0 110.831 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.72 -31.05 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.542 0.737 . . . . 0.0 110.928 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.656 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 27.6 ttpp -70.04 -39.47 75.73 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.627 0.771 . . . . 0.0 111.527 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.91 -47.7 43.53 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.495 0.718 . . . . 0.0 111.56 -178.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.06 -20.16 19.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -169.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -69.76 -27.01 73.76 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 123.322 0.389 . . . . 0.0 113.164 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.626 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 72.5 p -67.66 -30.35 69.87 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.646 0.778 . . . . 0.0 111.436 176.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.3 m -83.58 88.05 7.03 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.749 0.82 . . . . 0.0 109.89 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.87 62.53 5.71 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.54 0.686 . . . . 0.0 110.789 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.8 t -101.81 110.72 22.76 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 173.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.9 t -96.42 114.5 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.689 0.796 . . . . 0.0 110.846 -171.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.443 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 84.8 tttt -83.57 115.54 22.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.06 0.944 . . . . 0.0 108.483 166.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -73.86 131.69 41.75 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 0.0 110.287 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -138.91 -8.1 1.39 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.069 0.948 . . . . 0.0 110.395 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.1 p . . . . . 0 CA--C 1.549 0.907 0 CA-C-O 121.084 0.468 . . . . 0.0 110.211 174.794 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.414 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . . . . . . 0 CA--C 1.527 0.783 0 N-CA-C 113.657 0.223 . . . . 0.0 113.657 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.4 p90 -162.75 165.87 24.98 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.753 0.821 . . . . 0.0 110.683 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 69.1 m-85 -105.44 157.58 17.25 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.534 1.134 . . . . 0.0 108.731 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.494 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 74.8 mt-10 -137.18 110.09 7.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 169.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.7 tp -92.82 106.14 18.15 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 m -129.35 152.0 49.38 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HE3' ' HB ' ' A' ' 126' ' ' THR . 19.1 ptpt -106.51 148.59 28.03 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.038 0.446 . . . . 0.0 110.4 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -72.4 -178.03 2.4 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.345 1.058 . . . . 0.0 111.264 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.0 t -66.74 -29.74 69.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 122.875 0.47 . . . . 0.0 111.247 -178.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -86.52 15.15 5.78 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.026 0.53 . . . . 0.0 111.585 174.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.446 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 17.3 m120 68.68 14.03 8.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.912 1.285 . . . . 0.0 112.748 171.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.48 134.23 35.5 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.605 0.762 . . . . 0.0 109.272 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -86.97 140.52 29.5 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.544 0.738 . . . . 0.0 110.134 -169.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -152.72 115.7 4.6 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -93.35 138.2 31.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.56 HG12 HG23 ' A' ' 45' ' ' THR . 30.4 m -110.8 153.77 12.52 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 172.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 116' ' ' ASN . 0.4 OUTLIER -117.35 123.16 45.81 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.443 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -119.76 146.24 45.83 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 110.359 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.544 ' HA ' HD21 ' A' ' 116' ' ' ASN . . . -75.4 -178.71 4.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.77 0.828 . . . . 0.0 110.552 172.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -66.14 -17.98 66.47 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.562 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -88.33 -2.37 58.56 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.906 0.882 . . . . 0.0 112.192 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.37 2.82 88.98 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 113.989 0.355 . . . . 0.0 113.989 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -81.68 126.76 32.17 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.029 0.531 . . . . 0.0 110.095 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.1 m -70.09 120.63 16.08 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 pt -100.25 -26.49 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.965 1.306 . . . . 0.0 111.016 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.8 tp -151.54 120.93 6.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.368 0.667 . . . . 0.0 109.395 -174.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.56 HG23 HG12 ' A' ' 34' ' ' VAL . 59.4 m -119.63 122.07 40.71 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.417 0.687 . . . . 0.0 109.543 176.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.506 ' HG ' ' HE2' ' A' ' 49' ' ' TYR . 16.5 t -73.93 -176.28 2.43 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 122.764 0.426 . . . . 0.0 110.569 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -91.94 178.19 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.72 0.408 . . . . 0.0 110.469 172.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.6 mp -84.47 112.42 20.36 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -178.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.506 ' HE2' ' HG ' ' A' ' 46' ' ' SER . 82.1 m-85 -90.33 115.85 27.84 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.145 0.978 . . . . 0.0 108.569 170.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.4 p -69.97 -7.73 43.14 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.01 0.524 . . . . 0.0 111.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.9 m -119.33 135.31 54.78 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.546 1.138 . . . . 0.0 109.738 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -29.36 69.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.929 0.492 . . . . 0.0 110.655 174.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -63.98 -43.78 94.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.125 0.97 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.7 p -74.41 -28.27 61.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.176 0.59 . . . . 0.0 111.362 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.58 -36.01 82.5 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.95 0.5 . . . . 0.0 110.616 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -73.17 -37.19 66.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.578 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -61.07 -39.98 91.94 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.499 172.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.01 85.24 Favored Glycine 0 C--N 1.348 1.244 0 O-C-N 123.867 0.73 . . . . 0.0 113.226 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.2 tt -71.39 -32.0 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 CA-C-O 120.925 0.393 . . . . 0.0 111.0 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 -30.96 70.26 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.799 0.44 . . . . 0.0 110.557 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 m -74.06 -43.32 58.22 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.087 178.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.27 -27.95 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 CA-C-N 118.276 0.489 . . . . 0.0 110.521 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.29 -44.32 79.53 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.648 0.779 . . . . 0.0 109.498 176.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -78.08 -26.64 48.26 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.0 0.52 . . . . 0.0 111.497 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -103.26 13.68 33.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.88 0.872 . . . . 0.0 111.381 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 57.4 p -66.92 -45.89 54.03 Favored Pre-proline 0 CA--C 1.565 1.537 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.828 173.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.29 -7.07 15.97 Favored 'Trans proline' 0 C--N 1.397 3.097 0 CA-C-N 121.873 1.705 . . . . 0.0 112.433 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -83.1 77.16 9.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.537 0.735 . . . . 0.0 110.373 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -60.6 -35.82 77.06 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.703 1.201 . . . . 0.0 112.362 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -74.87 -23.9 58.47 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.272 0.629 . . . . 0.0 110.969 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -77.19 -21.37 54.04 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 123.341 0.657 . . . . 0.0 110.649 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -73.87 104.61 4.81 Favored 'General case' 0 C--N 1.356 0.886 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 167.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -96.86 113.23 24.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.282 0.633 . . . . 0.0 109.292 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 147.05 34.03 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 173.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -147.58 135.59 21.28 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.278 1.031 . . . . 0.0 108.954 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.7 m -98.32 125.19 43.34 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.07 164.85 26.1 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.025 0.93 . . . . 0.0 110.893 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -69.17 -26.37 64.82 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.435 0.694 . . . . 0.0 110.341 178.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -76.35 -4.64 43.33 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.43 1.092 . . . . 0.0 111.244 174.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.44 10.07 74.53 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.868 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -81.44 122.46 27.54 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 122.993 0.517 . . . . 0.0 110.306 -177.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -88.36 126.79 35.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -147.57 175.34 10.93 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -127.0 161.59 28.01 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.381 0.672 . . . . 0.0 110.503 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -140.42 124.19 17.24 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.439 1.096 . . . . 0.0 108.404 176.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.0 tp -84.57 106.59 16.25 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 172.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 91' ' ' HIS . 2.8 tmtm? -86.38 150.13 24.53 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.9 34.38 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.244 0.617 . . . . 0.0 110.365 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.53 -14.48 51.56 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.463 0.705 . . . . 0.0 111.931 177.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -85.94 14.82 5.57 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 0.0 111.475 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.419 ' HA ' ' HE3' ' A' ' 87' ' ' LYS . 71.8 m80 67.07 19.13 10.53 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.905 1.282 . . . . 0.0 112.164 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -109.76 147.45 33.2 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.682 0.793 . . . . 0.0 109.914 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.9 mm -90.12 105.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 170.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.7 pt -87.55 -7.87 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.16 145.71 9.08 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 123.407 0.442 . . . . 0.0 112.605 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -154.45 122.38 5.92 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.205 1.402 . . . . 0.0 108.917 174.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.8 p -67.89 153.74 43.07 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 172.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -60.59 -78.59 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.815 0.697 . . . . 0.0 111.169 -174.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.409 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 24.9 ptt? -173.28 121.97 0.37 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.389 1.076 . . . . 0.0 108.966 176.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -103.27 148.94 25.21 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.71 -37.53 35.47 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.636 174.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.6 p -114.45 147.76 38.81 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.357 0.663 . . . . 0.0 111.76 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.63 -22.45 64.41 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.535 176.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -58.82 -45.11 90.73 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.69 0.796 . . . . 0.0 111.164 173.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m -73.0 -23.99 60.7 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.363 0.665 . . . . 0.0 111.29 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.445 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.9 mtp180 -62.69 -51.11 68.48 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.663 0.385 . . . . 0.0 110.28 168.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -66.54 -34.61 78.29 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.943 0.897 . . . . 0.0 111.061 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.7 m -70.32 -34.68 72.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.929 0.492 . . . . 0.0 109.936 174.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.484 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.14 -50.68 64.59 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.448 173.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 106' ' ' ARG . 40.7 mm -56.4 -45.28 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.244 1.018 . . . . 0.0 110.065 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.84 89.5 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.821 0.848 . . . . 0.0 110.849 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.5 t -73.16 -34.94 66.33 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.763 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 109' ' ' GLY . 75.4 t -69.31 -37.28 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.139 0.576 . . . . 0.0 110.943 -178.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 66' ' ' SER . 10.4 mtmp? -69.93 -37.81 76.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.726 0.41 . . . . 0.0 110.616 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.62 76.19 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.71 177.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.544 HD21 ' HA ' ' A' ' 37' ' ' ALA . 2.4 m-20 -85.25 -11.42 54.88 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.145 0.978 . . . . 0.0 111.588 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.07 -36.23 60.67 Favored Glycine 0 C--N 1.344 0.997 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.8 t -82.58 -2.29 53.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.321 0.648 . . . . 0.0 111.308 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.4 t -73.61 160.39 31.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.345 0.658 . . . . 0.0 110.318 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.91 2.8 3.15 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.224 0.61 . . . . 0.0 111.517 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.2 t -79.82 101.25 8.4 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.212 0.605 . . . . 0.0 110.019 178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 m -110.07 141.72 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.03 0.532 . . . . 0.0 109.795 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.494 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 96.6 mttt -106.66 101.48 10.93 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.63 107.07 13.13 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -113.88 15.31 18.6 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.153 0.981 . . . . 0.0 110.922 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.571 ' HB ' ' HE3' ' A' ' 25' ' ' LYS . 46.4 p . . . . . 0 CA--C 1.545 0.786 0 C-N-CA 123.095 0.558 . . . . 0.0 111.56 -176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.453 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.404 ' HA ' HG23 ' A' ' 121' ' ' THR . 43.5 p90 -157.58 155.3 29.93 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.881 0.872 . . . . 0.0 110.051 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.416 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 73.3 m-85 -98.72 140.83 32.34 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.881 0.873 . . . . 0.0 108.772 174.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.423 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 37.3 mt-10 -126.35 111.09 14.1 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 170.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 21.3 tp -92.67 100.22 12.77 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.445 0.698 . . . . 0.0 109.216 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.4 t -116.34 152.61 33.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.87 0.868 . . . . 0.0 109.1 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -95.4 158.09 15.61 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 74.0 p -92.74 173.83 7.57 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.339 0.655 . . . . 0.0 110.381 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 t -69.07 -19.78 64.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.229 0.612 . . . . 0.0 109.87 170.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -87.86 9.31 22.37 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.75 0.82 . . . . 0.0 110.36 172.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 79.77 -22.07 0.3 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 125.254 1.422 . . . . 0.0 113.129 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -68.87 136.06 52.06 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.554 0.741 . . . . 0.0 111.222 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -92.38 131.07 37.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.932 0.893 . . . . 0.0 109.704 -170.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -147.17 121.63 9.7 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.598 0.759 . . . . 0.0 109.549 -173.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -93.07 141.97 27.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 27.6 m -117.45 136.09 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.366 1.066 . . . . 0.0 109.677 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -91.83 115.61 28.2 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -109.72 123.92 50.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.155 0.982 . . . . 0.0 108.673 174.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.66 170.73 4.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.91 0.484 . . . . 0.0 110.959 172.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.4 -10.13 46.91 Favored Glycine 0 N--CA 1.477 1.415 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.23 -8.34 58.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.614 1.166 . . . . 0.0 110.876 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.06 10.88 84.36 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.883 -176.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -101.85 132.36 47.67 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.13 0.972 . . . . 0.0 109.813 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.0 m -70.17 118.32 12.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 pt -99.78 -16.43 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.167 0.987 . . . . 0.0 110.964 -178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.9 tp -154.65 139.1 16.8 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 40.4 m -135.29 123.44 22.94 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.8 t -79.98 177.68 8.76 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.46 0.704 . . . . 0.0 111.755 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -72.36 166.68 22.04 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.236 0.614 . . . . 0.0 111.812 172.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.01 113.21 18.0 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 171.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.9 m-85 -93.66 138.73 31.58 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.423 0.689 . . . . 0.0 109.947 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t -74.69 -13.78 60.66 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.441 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.8 m -139.31 148.79 43.43 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.832 0.853 . . . . 0.0 110.143 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.8 tmmm? -64.63 -38.72 91.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.285 1.034 . . . . 0.0 108.678 176.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -62.85 -34.46 77.39 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.544 0.738 . . . . 0.0 111.741 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 51.0 m -64.83 -32.76 74.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.22 0.608 . . . . 0.0 111.158 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.12 -29.29 62.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.135 0.574 . . . . 0.0 111.314 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 -37.86 74.94 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.353 0.661 . . . . 0.0 110.077 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 57' ' ' LYS . 8.0 mtpm? -66.39 -35.01 79.24 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.956 171.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.97 91.66 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.586 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.485 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.7 tt -68.16 -36.45 75.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.034 0 CA-C-N 116.952 0.376 . . . . 0.0 110.368 177.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.11 -36.03 72.3 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.012 0.525 . . . . 0.0 110.736 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.0 m -73.64 -47.82 37.13 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.43 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 59' ' ' ILE . 11.1 m -66.42 -28.71 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-N 117.708 0.231 . . . . 0.0 110.854 -178.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.628 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 78.7 ttt-85 -78.22 -39.07 41.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.351 1.06 . . . . 0.0 110.684 -176.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.1 t -70.21 -35.09 73.67 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.3 175.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -97.62 4.59 50.13 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.812 0.845 . . . . 0.0 111.272 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -66.25 -46.52 61.41 Favored Pre-proline 0 CA--C 1.562 1.407 0 C-N-CA 123.904 0.882 . . . . 0.0 111.668 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.63 -18.68 32.73 Favored 'Trans proline' 0 C--N 1.393 2.914 0 C-N-CA 121.761 1.64 . . . . 0.0 112.818 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -95.72 97.23 9.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.957 0.503 . . . . 0.0 110.762 -172.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -21.61 66.71 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.209 0.603 . . . . 0.0 111.721 175.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.38 -33.65 21.35 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.783 1.633 . . . . 0.0 111.775 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -96.03 16.63 17.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.931 0.892 . . . . 0.0 112.069 -172.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -111.01 131.75 54.79 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 6.4 mm-40 -96.21 97.89 9.88 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.979 0.912 . . . . 0.0 109.196 -176.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 105.41 2.75 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.901 0.751 . . . . 0.0 109.915 179.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -136.56 160.99 37.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.498 0.719 . . . . 0.0 110.324 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.0 m -127.57 116.48 20.41 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.725 176.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.52 153.23 13.28 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 110.858 170.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -61.65 -15.26 38.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.839 0.856 . . . . 0.0 112.452 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -86.61 11.72 12.19 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.879 0.871 . . . . 0.0 111.618 178.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.28 24.84 74.54 Favored Glycine 0 C--N 1.352 1.437 0 O-C-N 123.105 0.253 . . . . 0.0 112.738 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.1 mmtp -109.4 123.12 48.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.351 0.66 . . . . 0.0 110.219 -175.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -79.68 135.38 36.53 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.495 0.718 . . . . 0.0 109.905 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -151.47 140.07 20.67 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 4.0 m-85 -109.52 133.22 53.35 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.451 HD22 HD13 ' A' ' 93' ' ' ILE . 9.6 m-20 -105.63 125.38 50.91 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.456 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.86 122.36 28.13 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -86.24 138.23 32.02 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.438 1.095 . . . . 0.0 109.644 -175.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.544 ' HB2' HG23 ' A' ' 94' ' ' ILE . . . -95.15 168.25 10.87 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.904 0.882 . . . . 0.0 110.37 175.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.15 -19.48 62.42 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.233 0.613 . . . . 0.0 111.051 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.454 ' HB3' ' HG2' ' A' ' 92' ' ' GLN . 62.1 t30 -82.72 0.85 41.56 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.891 0.877 . . . . 0.0 111.543 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 69.43 18.08 7.95 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.688 1.195 . . . . 0.0 111.62 -176.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.454 ' HG2' ' HB3' ' A' ' 90' ' ' ASN . 4.2 pt20 -100.87 -170.49 1.85 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.634 0.774 . . . . 0.0 109.236 173.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.451 HD13 HD22 ' A' ' 85' ' ' ASN . 59.3 mt -106.63 148.01 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 175.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.544 HG23 ' HB2' ' A' ' 88' ' ' ALA . 5.6 pt -126.83 -1.15 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.25 1.02 . . . . 0.0 111.058 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 176.78 104.2 0.18 Allowed Glycine 0 C--N 1.35 1.361 0 N-CA-C 114.118 0.407 . . . . 0.0 114.118 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 m -88.83 125.87 35.1 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 98.6 p -75.81 167.37 22.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 120.76 0.314 . . . . 0.0 111.088 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -60.94 157.31 15.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.699 0.8 . . . . 0.0 110.613 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.408 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 25.3 ptt? -78.7 119.43 21.92 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 121.17 0.509 . . . . 0.0 109.892 178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -98.47 120.11 38.32 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.97 0.908 . . . . 0.0 109.543 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.09 -35.29 71.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.992 0.517 . . . . 0.0 110.774 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 m -100.25 154.47 18.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.286 0.634 . . . . 0.0 110.413 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -84.44 -24.75 29.4 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.768 0.827 . . . . 0.0 111.851 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -79.8 -32.15 40.76 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 173.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -29.77 69.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.961 0.505 . . . . 0.0 111.698 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.8 ptt180 -65.98 -33.54 76.05 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.502 177.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -69.04 -42.44 76.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.202 0.601 . . . . 0.0 110.095 -179.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.4 m -69.64 -41.96 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.519 0.728 . . . . 0.0 111.062 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -68.71 -38.1 85.32 Favored Glycine 0 C--N 1.342 0.901 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.933 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.464 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 35.5 mm -76.77 -38.82 30.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.711 0.405 . . . . 0.0 110.206 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.44 -26.83 68.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.619 0.368 . . . . 0.0 110.757 173.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.5 t -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 92.6 t -59.28 -37.21 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.564 0.746 . . . . 0.0 110.796 175.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 110' ' ' ILE . 7.5 mtpm? -71.27 -33.1 69.47 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.545 0.738 . . . . 0.0 111.026 177.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.42 -51.71 14.17 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.626 0.771 . . . . 0.0 112.558 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -103.77 -4.15 24.02 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.819 0.847 . . . . 0.0 112.267 -173.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.74 -20.52 78.69 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.723 -0.217 . . . . 0.0 113.056 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.628 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 13.8 t -81.24 3.58 23.36 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.599 0.759 . . . . 0.0 111.596 176.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.0 t -89.93 169.3 11.34 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.766 0.426 . . . . 0.0 110.696 178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -123.35 11.09 9.3 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.797 0.839 . . . . 0.0 111.3 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 20' ' ' TRP . 6.2 t -74.46 80.94 1.93 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-O 121.739 0.781 . . . . 0.0 111.53 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 27.7 m -97.49 124.69 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.357 0.663 . . . . 0.0 110.499 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 3.7 mptp? -96.29 82.12 3.39 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 171.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 7.1 p-10 -72.56 96.77 2.01 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.021 0.915 . . . . 0.0 109.025 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -93.42 8.8 39.12 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.783 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 42.6 p . . . . . 0 CA--C 1.547 0.853 0 C-N-CA 124.411 1.084 . . . . 0.0 110.095 174.386 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 36' ' ' LYS . . . . . . . . 0 CA--C 1.524 0.607 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.435 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.5 p90 -161.35 153.16 19.38 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.608 0.763 . . . . 0.0 110.786 -173.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.487 ' HB2' HG22 ' A' ' 122' ' ' VAL . 97.5 m-85 -88.51 156.74 18.92 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.463 0.705 . . . . 0.0 109.391 169.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -138.58 107.67 6.04 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 33' ' ' PHE . 37.7 tp -95.46 101.12 12.81 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.344 0.658 . . . . 0.0 109.571 -177.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.3 t -116.84 -177.74 3.27 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 123.629 0.771 . . . . 0.0 109.022 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -141.39 161.27 38.31 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -82.95 177.36 8.66 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.18 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.8 m -70.64 -22.36 62.52 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.132 0.573 . . . . 0.0 110.184 172.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.28 -5.22 48.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.841 0.856 . . . . 0.0 111.851 171.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 69.78 27.15 4.67 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.984 1.314 . . . . 0.0 111.698 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -87.15 119.66 27.61 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -88.61 142.26 27.84 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.74 0.816 . . . . 0.0 109.314 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.428 ' HD2' HD23 ' A' ' 48' ' ' LEU . 58.8 ttt180 -157.43 117.37 3.41 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 -171.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.431 ' HB3' HD13 ' A' ' 23' ' ' LEU . 46.9 p90 -98.82 133.06 43.67 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 HG23 ' A' ' 45' ' ' THR . 17.7 m -107.78 130.76 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.687 0.795 . . . . 0.0 109.05 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.4 tp -100.67 117.57 35.06 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 97.6 mttt -120.37 142.01 49.56 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.591 1.157 . . . . 0.0 109.516 -176.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.34 -175.92 0.87 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.067 0.947 . . . . 0.0 111.677 173.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.98 -21.76 63.94 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 -176.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -84.34 -4.3 58.79 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.644 0.777 . . . . 0.0 112.533 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.84 8.4 87.71 Favored Glycine 0 C--N 1.343 0.943 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -82.42 132.15 35.21 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.729 0.812 . . . . 0.0 109.423 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.3 m -64.97 123.76 20.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.358 0.663 . . . . 0.0 112.007 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.484 HD11 ' HG ' ' A' ' 35' ' ' LEU . 29.9 pt -105.85 -14.45 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.141 0.976 . . . . 0.0 110.401 172.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 11.6 tp -165.59 144.49 6.26 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.795 0.838 . . . . 0.0 109.002 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.465 HG23 HG12 ' A' ' 34' ' ' VAL . 26.9 m -152.19 114.01 4.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.956 0.903 . . . . 0.0 109.221 176.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.3 m -64.26 170.17 3.99 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.212 1.005 . . . . 0.0 112.014 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.65 174.63 11.39 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.888 0.375 . . . . 0.0 110.21 175.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.428 HD23 ' HD2' ' A' ' 32' ' ' ARG . 66.6 mt -71.71 113.66 8.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.183 0.593 . . . . 0.0 109.748 177.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -90.02 137.4 32.37 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.393 0.677 . . . . 0.0 109.998 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.9 t -69.16 -21.49 63.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.225 0.61 . . . . 0.0 111.624 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p -149.68 156.7 42.32 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.777 0.831 . . . . 0.0 110.371 -174.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -66.94 -28.82 68.6 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 177.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.9 p -59.0 -39.86 83.1 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 123.982 0.801 . . . . 0.0 110.79 176.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.9 m -71.85 -30.05 65.04 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.715 0.806 . . . . 0.0 111.383 177.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.67 -39.06 64.7 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.216 0.606 . . . . 0.0 110.986 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.73 -34.96 72.43 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.881 0.872 . . . . 0.0 110.058 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -62.07 -44.0 97.62 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.367 1.067 . . . . 0.0 109.74 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.84 -49.37 78.67 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.227 0.955 . . . . 0.0 113.042 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.568 ' HA ' HG22 ' A' ' 62' ' ' VAL . 14.9 tt -72.78 -33.83 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 122.297 0.239 . . . . 0.0 111.364 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.8 -32.07 73.39 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.901 0.48 . . . . 0.0 110.934 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.5 m -75.92 -45.45 35.1 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.509 176.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' A' ' 59' ' ' ILE . 24.1 m -66.66 -36.62 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 118.005 0.366 . . . . 0.0 111.185 -175.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.09 73.53 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.337 0.589 . . . . 0.0 110.142 -177.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.6 t -77.33 -32.7 55.39 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.973 0.909 . . . . 0.0 110.372 177.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.57 10.7 40.88 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.698 0.799 . . . . 0.0 111.385 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.566 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.6 m -58.76 -46.82 99.54 Favored Pre-proline 0 N--CA 1.484 1.251 0 C-N-CA 123.391 0.676 . . . . 0.0 112.618 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.18 -13.07 15.63 Favored 'Trans proline' 0 C--N 1.391 2.782 0 C-N-CA 121.559 1.506 . . . . 0.0 113.124 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -82.71 77.64 9.43 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -178.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 0.4 OUTLIER -64.45 -20.66 66.31 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.979 -177.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -67.05 -37.89 84.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.767 0.827 . . . . 0.0 110.923 174.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -71.01 -23.61 62.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.273 0.629 . . . . 0.0 111.679 178.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.413 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 67.8 m-85 -71.63 115.33 10.69 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 164.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.515 ' HB3' HD22 ' A' ' 85' ' ' ASN . 36.8 tt0 -97.23 117.76 32.16 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.097 0.959 . . . . 0.0 108.865 -173.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.607 ' H ' ' HD2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.72 105.36 4.99 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 110.633 -174.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -100.18 115.32 29.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.325 1.05 . . . . 0.0 109.52 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.0 m -112.75 111.44 22.23 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB3' ' HB2' ' A' ' 81' ' ' LYS . . . -69.37 153.04 44.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.393 173.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 p -61.82 -21.29 64.5 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.826 0.85 . . . . 0.0 111.573 175.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -84.03 11.51 7.8 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.821 0.848 . . . . 0.0 111.493 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.48 17.25 77.71 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 113.236 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 75.5 mmtt -84.25 123.12 29.8 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -102.8 124.14 47.77 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.464 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 8.1 p90 -152.81 177.94 10.18 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.955 1.302 . . . . 0.0 108.467 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.56 157.41 44.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.507 0.323 . . . . 0.0 111.329 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.515 HD22 ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -135.61 129.97 33.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.112 0.565 . . . . 0.0 110.183 168.033 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.777 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -81.07 115.23 20.41 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -94.11 137.59 33.13 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.805 0.842 . . . . 0.0 109.794 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -93.95 175.85 6.56 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.004 0.922 . . . . 0.0 110.74 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.73 -23.41 66.74 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.77 0.828 . . . . 0.0 111.474 175.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -84.57 5.24 28.53 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.216 1.007 . . . . 0.0 111.566 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 66.95 10.46 7.67 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.087 1.355 . . . . 0.0 112.238 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.17 148.64 23.54 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.094 0.557 . . . . 0.0 110.558 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.528 HG21 ' HB2' ' A' ' 96' ' ' SER . 54.9 mt -78.22 99.99 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 170.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.777 HD11 HD22 ' A' ' 86' ' ' LEU . 14.3 pt -81.26 -6.75 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.222 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -179.58 121.31 0.73 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-O 119.345 -0.697 . . . . 0.0 111.812 173.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.528 ' HB2' HG21 ' A' ' 93' ' ' ILE . 23.1 t -119.31 113.71 21.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.858 0.863 . . . . 0.0 110.468 177.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.5 t -65.29 161.14 20.11 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.762 0.825 . . . . 0.0 111.372 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -88.95 163.46 15.56 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.296 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.554 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 17.6 ptt? -73.14 120.68 19.09 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.388 0.675 . . . . 0.0 111.668 -173.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -101.11 157.12 17.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.208 173.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.46 -46.0 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.837 0.455 . . . . 0.0 111.277 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.5 p -101.45 153.74 19.43 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 123.27 0.628 . . . . 0.0 110.88 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.41 82.44 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.888 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -59.56 -29.94 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.417 0.687 . . . . 0.0 112.763 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.2 m -71.56 -40.48 69.95 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 112.073 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.447 ' O ' HG12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -76.21 -26.83 56.51 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.395 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -65.89 -43.13 89.14 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 122.983 0.513 . . . . 0.0 110.138 172.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.7 m -63.6 -33.9 76.63 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.897 171.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.34 -40.0 98.44 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.944 0.777 . . . . 0.0 113.247 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 106' ' ' ARG . 44.5 mm -60.04 -46.22 94.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-O 121.213 0.53 . . . . 0.0 109.741 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.92 78.9 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.52 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.4 t -71.8 -43.27 65.95 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.147 0.579 . . . . 0.0 110.455 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.3 t -73.56 -24.72 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.43 0.692 . . . . 0.0 110.56 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.566 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.7 OUTLIER -62.47 -45.88 91.04 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 172.682 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.41 -50.15 16.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.998 -175.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -84.17 -26.9 28.45 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.154 0.982 . . . . 0.0 111.178 -172.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . 0.446 ' HA2' ' HZ ' ' A' ' 21' ' ' PHE . . . -65.41 -43.2 95.31 Favored Glycine 0 C--N 1.346 1.114 0 O-C-N 123.613 0.571 . . . . 0.0 112.797 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 46.6 p -68.56 -27.7 66.31 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.586 0.754 . . . . 0.0 111.76 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -75.28 121.81 22.75 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.425 0.69 . . . . 0.0 110.15 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.04 43.34 1.14 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.368 1.067 . . . . 0.0 111.159 -174.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.435 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.6 t -95.36 111.93 23.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.108 0.963 . . . . 0.0 108.847 176.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 21' ' ' PHE . 27.0 t -134.73 135.33 53.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.245 0.618 . . . . 0.0 110.044 -174.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -91.38 95.31 9.92 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 166.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -75.12 95.03 3.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.689 0.757 . . . . 0.0 109.292 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -107.31 27.35 9.17 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.581 -1.191 . . . . 0.0 110.393 -178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 45.3 p . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 123.669 0.788 . . . . 0.0 110.814 -177.617 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.652 0 N-CA-C 112.033 -0.427 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -146.1 157.38 43.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.167 0.987 . . . . 0.0 109.581 -177.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -99.5 151.31 21.28 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.468 0.707 . . . . 0.0 110.015 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 48.3 mt-10 -137.29 115.05 11.33 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.431 1.092 . . . . 0.0 108.5 171.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.6 tp -80.45 98.41 7.52 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.3 p -94.09 155.06 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.343 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 29' ' ' ASN . 12.5 ptmm? -113.65 165.81 12.16 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.495 0.718 . . . . 0.0 109.285 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -102.27 -178.94 3.84 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.055 0.542 . . . . 0.0 109.955 174.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.4 t -65.9 -27.21 68.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.032 0.533 . . . . 0.0 110.351 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.24 2.87 22.75 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.78 0.832 . . . . 0.0 111.728 174.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.432 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 12.3 t30 70.35 9.64 7.03 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.876 1.27 . . . . 0.0 111.477 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -74.63 131.48 40.95 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.153 0.581 . . . . 0.0 109.997 -177.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -92.58 137.63 32.2 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.03 0.932 . . . . 0.0 110.384 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -155.65 141.6 18.18 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -103.24 136.82 42.3 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 HG23 ' A' ' 45' ' ' THR . 27.7 m -107.36 132.82 53.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 175.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.7 tp -100.22 114.98 28.82 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 171.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.54 141.61 35.71 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.395 1.078 . . . . 0.0 108.897 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.27 175.46 10.63 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.038 0.535 . . . . 0.0 110.201 171.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.94 -7.45 56.09 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 113.914 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -73.17 -18.37 61.28 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.001 0.92 . . . . 0.0 111.053 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.61 -7.51 74.47 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.413 -173.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -88.48 136.91 32.76 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.095 0.958 . . . . 0.0 110.176 -177.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.7 m -75.78 121.41 22.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.014 0.526 . . . . 0.0 109.786 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.39 -25.14 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.898 0.879 . . . . 0.0 110.839 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.0 tp -148.01 143.6 27.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.218 0.607 . . . . 0.0 109.963 -171.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.405 HG23 HG12 ' A' ' 34' ' ' VAL . 87.8 m -149.81 129.93 13.58 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.197 0.999 . . . . 0.0 108.806 175.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.4 p -78.6 170.85 16.0 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.134 0.573 . . . . 0.0 111.024 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 93' ' ' ILE . 7.9 pt-20 -70.17 170.15 12.17 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.078 0.551 . . . . 0.0 111.049 175.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.25 112.12 13.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -92.79 142.06 27.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.061 0.945 . . . . 0.0 109.761 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.7 p -72.51 -25.93 61.58 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.295 0.638 . . . . 0.0 111.022 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.5 m -124.42 138.43 54.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.926 0.89 . . . . 0.0 110.153 -175.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -67.47 -28.12 67.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.858 0.463 . . . . 0.0 110.475 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.5 p -57.67 -40.77 80.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.161 0.984 . . . . 0.0 110.985 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -65.93 -35.14 79.78 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.917 0.887 . . . . 0.0 111.127 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.3 -33.15 61.17 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.44 0.696 . . . . 0.0 111.411 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -69.86 -43.54 71.66 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.631 0.773 . . . . 0.0 110.195 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.13 -22.45 52.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.58 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.18 75.69 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.708 0.63 . . . . 0.0 112.622 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' HG22 ' A' ' 62' ' ' VAL . 6.1 tt -67.48 -33.07 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 122.699 0.4 . . . . 0.0 110.795 176.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.81 82.32 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.107 0.479 . . . . 0.0 110.346 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -76.09 -39.64 54.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.355 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 59' ' ' ILE . 19.9 m -64.59 -33.11 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 CA-C-N 119.204 0.911 . . . . 0.0 110.495 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -70.6 -39.4 73.81 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 124.265 0.978 . . . . 0.0 110.624 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.8 t -74.14 -30.72 62.43 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.539 0.736 . . . . 0.0 110.841 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -107.55 18.35 21.59 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.786 0.835 . . . . 0.0 111.256 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.63 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 55.5 m -59.81 -49.63 90.66 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 123.398 0.679 . . . . 0.0 111.762 168.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.66 -4.65 12.97 Favored 'Trans proline' 0 C--N 1.398 3.165 0 C-N-CA 121.968 1.779 . . . . 0.0 113.098 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -92.67 81.7 4.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.965 0.506 . . . . 0.0 110.126 -173.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.55 -29.99 59.97 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 124.52 1.128 . . . . 0.0 112.265 176.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -63.26 -35.39 80.2 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.164 1.386 . . . . 0.0 110.514 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -76.14 -23.11 54.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.609 0.764 . . . . 0.0 112.117 -176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -73.91 138.63 44.4 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 73.3 mm-40 -98.97 95.34 7.08 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.7 103.68 15.38 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 56.7 mttm -124.5 157.3 35.62 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 109.348 -175.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.5 m -127.23 115.54 19.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.644 0.778 . . . . 0.0 109.563 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.23 159.7 5.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.162 0.985 . . . . 0.0 111.83 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.6 p -57.69 -27.0 62.51 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.328 1.051 . . . . 0.0 112.806 -174.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -88.83 16.53 6.71 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 112.109 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.77 31.83 62.03 Favored Glycine 0 C--N 1.35 1.339 0 CA-C-N 116.372 -0.376 . . . . 0.0 113.335 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.7 mmtt -101.41 122.1 43.14 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.082 0.553 . . . . 0.0 109.848 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -95.2 130.86 41.76 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.484 0.714 . . . . 0.0 109.491 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.448 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 45.6 p90 -149.37 161.44 42.06 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.302 0.641 . . . . 0.0 109.616 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 42.2 p90 -130.91 135.9 48.1 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.206 0.602 . . . . 0.0 109.865 176.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.64 117.21 31.65 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 172.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 94' ' ' ILE . 0.8 OUTLIER -76.68 109.38 10.4 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.337 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -90.22 137.67 32.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.857 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -100.01 154.69 18.19 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.522 0.729 . . . . 0.0 109.19 169.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.03 -16.44 61.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -74.8 1.85 11.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.474 1.11 . . . . 0.0 111.993 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.0 m170 68.6 14.71 9.08 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.238 1.415 . . . . 0.0 111.428 -177.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -103.86 140.86 37.09 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.308 0.643 . . . . 0.0 109.632 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 47' ' ' GLU . 51.2 mm -80.13 98.39 3.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.996 0.919 . . . . 0.0 108.877 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 86' ' ' LEU . 24.7 pt -81.99 -12.9 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.511 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.69 142.17 8.51 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 t -153.55 165.29 36.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.645 0.778 . . . . 0.0 109.63 175.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 t -143.7 148.76 36.2 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.406 ' NE2' ' HG2' ' A' ' 99' ' ' MET . 0.0 OUTLIER -68.93 -42.61 76.54 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.715 0.635 . . . . 0.0 110.483 -175.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.469 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 27.7 ptt? 176.24 155.08 0.21 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.425 1.49 . . . . 0.0 108.632 171.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -103.59 128.68 50.82 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 165.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.58 98.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.914 0.886 . . . . 0.0 111.587 -173.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 p -111.81 146.59 37.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.097 0.959 . . . . 0.0 110.425 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -75.33 -16.66 60.39 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.637 0.775 . . . . 0.0 111.797 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.66 -33.37 62.49 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.399 0.68 . . . . 0.0 110.384 173.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.1 t -67.88 -20.08 65.09 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 17.2 ptt180 -55.99 -37.85 69.67 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 122.915 0.486 . . . . 0.0 110.97 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.18 -39.31 71.93 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.339 1.056 . . . . 0.0 110.127 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.82 -40.12 96.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.142 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.73 -47.04 70.05 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.888 -178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 43.1 mm -59.38 -45.16 93.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 122.785 0.434 . . . . 0.0 109.963 176.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.35 86.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.579 0.751 . . . . 0.0 111.423 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.2 t -76.05 -38.27 57.33 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.163 0.585 . . . . 0.0 111.058 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.32 -34.58 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.384 0.673 . . . . 0.0 110.538 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.9 OUTLIER -69.17 -48.66 61.62 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.48 0.712 . . . . 0.0 109.963 178.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 118' ' ' THR . . . -70.26 -51.28 31.81 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.142 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -83.53 0.21 47.51 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.453 0.701 . . . . 0.0 111.96 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.94 -30.97 72.23 Favored Glycine 0 C--N 1.347 1.147 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 115' ' ' ALA . 11.5 t -85.23 0.78 50.78 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.786 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.1 m -67.15 108.87 2.83 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 122.905 0.482 . . . . 0.0 110.214 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -73.33 -14.61 61.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.746 0.418 . . . . 0.0 111.462 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.4 t -66.04 103.55 0.97 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.571 0.748 . . . . 0.0 110.282 176.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.51 122.37 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 123.867 0.867 . . . . 0.0 110.064 177.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.45 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 22.1 mtpp -83.05 148.36 27.59 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.078 173.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -106.24 94.83 5.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -81.89 -10.98 59.13 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.841 0.856 . . . . 0.0 111.152 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.412 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 37.8 p . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 124.363 1.065 . . . . 0.0 112.261 -174.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.364 -0.294 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.9 m -95.27 157.35 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.837 0.855 . . . . 0.0 110.917 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.2 pt -69.87 123.85 24.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 123.118 0.567 . . . . 0.0 110.536 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -86.47 146.05 26.57 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.57 90.26 2.82 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.27 -169.65 22.89 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.468 -0.787 . . . . 0.0 113.265 -176.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.1 p90 -160.03 150.13 18.39 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.195 0.522 . . . . 0.0 111.027 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -94.32 149.35 21.33 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.178 0.991 . . . . 0.0 108.598 170.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.6 mt-10 -131.37 109.5 10.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 171.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.5 tp -87.16 107.98 18.71 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.5 t -122.62 142.96 50.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.935 0.894 . . . . 0.0 109.045 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -94.7 139.65 30.95 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 171.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.0 m -76.38 -175.54 3.29 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 0.0 111.687 -174.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.6 t -61.16 -25.78 67.25 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.062 0.545 . . . . 0.0 111.181 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -95.63 16.16 18.01 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.053 0.941 . . . . 0.0 110.787 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 64.06 17.62 10.73 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.261 1.424 . . . . 0.0 112.992 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 86.5 mm-40 -82.5 127.49 33.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.529 0.731 . . . . 0.0 110.724 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -85.89 122.11 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.836 0.854 . . . . 0.0 109.076 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -147.39 120.39 8.79 Favored 'General case' 0 C--O 1.242 0.658 0 C-N-CA 124.171 0.989 . . . . 0.0 108.556 -172.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -99.18 137.9 37.04 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.3 m -107.53 131.72 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.6 tp -91.36 123.49 34.82 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -115.7 149.76 37.89 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 109.172 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.54 -173.75 4.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.313 1.045 . . . . 0.0 110.275 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -57.34 -34.6 68.38 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 114.509 0.564 . . . . 0.0 114.509 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -88.66 8.1 30.26 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.623 0.769 . . . . 0.0 112.005 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.49 6.43 89.3 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.797 -0.183 . . . . 0.0 113.302 -176.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.85 110.06 4.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 110.424 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -65.08 121.37 14.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.5 pt -114.38 -20.78 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.61 1.164 . . . . 0.0 110.897 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -147.81 146.52 29.17 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.9 m -145.78 118.12 8.44 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.745 0.818 . . . . 0.0 108.936 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 98.1 p -69.21 170.19 10.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.748 0.419 . . . . 0.0 110.871 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.84 175.15 10.32 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 121.358 0.599 . . . . 0.0 110.895 174.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 89.0 mt -75.67 113.03 12.65 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.86 178.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.533 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 66.6 m-85 -100.97 133.61 45.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.685 0.794 . . . . 0.0 109.319 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 25.3 m -68.34 -25.56 65.16 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.155 0.582 . . . . 0.0 111.059 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -130.05 147.09 51.76 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.474 0.71 . . . . 0.0 110.981 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -27.8 68.77 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.781 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.8 p -57.63 -36.69 72.15 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.815 0.846 . . . . 0.0 111.782 175.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.533 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 13.2 m -69.8 -33.03 71.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.605 0.762 . . . . 0.0 110.752 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.67 59.89 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.531 0.732 . . . . 0.0 111.503 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -69.39 -45.26 69.72 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.288 0.635 . . . . 0.0 109.759 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -71.29 -24.72 62.2 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.81 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -64.14 -51.13 55.64 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.659 -0.576 . . . . 0.0 111.659 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.543 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.8 tt -71.39 -34.29 53.06 Favored 'Isoleucine or valine' 0 C--N 1.357 0.911 0 CA-C-N 116.641 0.221 . . . . 0.0 111.02 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.72 86.25 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.245 0.545 . . . . 0.0 110.275 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.6 m -74.17 -43.67 56.41 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.365 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 59' ' ' ILE . 13.2 m -65.05 -29.23 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-N 119.046 0.839 . . . . 0.0 111.036 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -76.02 -35.44 59.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.041 0.536 . . . . 0.0 110.277 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -77.83 -31.77 51.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.462 0.705 . . . . 0.0 110.844 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -101.92 12.13 37.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.752 0.821 . . . . 0.0 110.9 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.9 t -64.35 -48.93 74.68 Favored Pre-proline 0 CA--C 1.559 1.325 0 C-N-CA 123.919 0.888 . . . . 0.0 111.285 174.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -78.99 -9.52 15.47 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 121.744 1.629 . . . . 0.0 112.733 174.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -84.92 81.22 8.99 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -59.68 -28.09 66.98 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.377 1.071 . . . . 0.0 112.256 -177.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -78.54 -23.88 45.97 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.442 ' NE ' ' HB2' ' A' ' 87' ' ' LYS . 6.5 tpm_? -75.5 -21.9 57.62 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 111.435 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -70.48 133.51 46.88 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 169.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 43.5 mm-40 -96.18 97.11 9.28 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -78.31 103.63 8.38 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -122.4 159.49 27.44 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.872 1.269 . . . . 0.0 110.056 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.5 m -128.26 115.94 19.09 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.443 0.697 . . . . 0.0 109.732 174.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.18 156.47 31.66 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.802 0.841 . . . . 0.0 111.342 175.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.4 m -67.08 -10.8 53.82 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 124.028 0.931 . . . . 0.0 111.811 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.86 4.9 17.66 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 123.902 0.881 . . . . 0.0 110.083 172.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 34.13 67.87 Favored Glycine 0 C--N 1.352 1.434 0 C-N-CA 123.206 0.432 . . . . 0.0 112.731 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.6 mmtt -114.32 124.52 52.2 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.188 0.595 . . . . 0.0 110.211 -173.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.49 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 77.4 m-85 -91.78 125.79 36.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.308 0.643 . . . . 0.0 109.876 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.635 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 25.3 p90 -146.66 174.75 11.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.244 1.018 . . . . 0.0 108.921 -177.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.498 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 44.9 p90 -145.0 135.49 24.29 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.786 0.326 . . . . 0.0 111.345 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.54 ' HB3' HD12 ' A' ' 93' ' ' ILE . 6.1 m-20 -112.48 114.88 27.79 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.589 0.756 . . . . 0.0 109.328 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 41.5 tp -80.23 119.06 22.48 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.442 ' HB2' ' NE ' ' A' ' 71' ' ' ARG . 34.0 mmtp -87.11 156.85 19.55 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.009 0.924 . . . . 0.0 111.27 -177.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.6 175.14 5.6 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.227 167.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.39 -28.25 69.86 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.525 0.678 . . . . 0.0 110.63 172.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -81.91 10.81 5.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.456 1.103 . . . . 0.0 112.153 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 66.59 4.89 3.54 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.78 1.232 . . . . 0.0 111.983 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -85.38 140.83 30.45 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.771 0.828 . . . . 0.0 110.427 -173.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.54 HD12 ' HB3' ' A' ' 85' ' ' ASN . 20.5 mm -76.14 99.67 2.0 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 14.2 pt -79.44 -11.37 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.019 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.38 108.2 0.26 Allowed Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.3 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.423 ' HB3' HG21 ' A' ' 93' ' ' ILE . 77.8 p -92.01 134.54 34.72 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -88.39 160.32 17.63 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-O 121.169 0.509 . . . . 0.0 109.855 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -72.82 141.42 48.01 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.865 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.635 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.1 ptt? -73.47 116.51 14.13 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.413 0.625 . . . . 0.0 109.645 -176.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -93.35 158.32 15.8 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.252 -176.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 -54.68 7.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 122.567 0.347 . . . . 0.0 110.453 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 p -97.36 155.85 16.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.371 0.668 . . . . 0.0 111.782 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -70.49 -33.54 71.34 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.641 0.777 . . . . 0.0 110.895 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -63.08 -32.19 73.51 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.004 0.522 . . . . 0.0 111.292 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -71.48 -30.1 65.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.432 0.693 . . . . 0.0 110.662 177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.49 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 57.5 ttp180 -69.77 -38.73 76.85 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.319 0.648 . . . . 0.0 109.949 174.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 22.3 mm-40 -71.14 -40.08 71.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.244 0.618 . . . . 0.0 110.986 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.4 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.466 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.94 -44.63 97.56 Favored Glycine 0 C--N 1.347 1.18 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.471 174.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.93 -46.44 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 123.435 0.694 . . . . 0.0 109.961 176.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.48 80.23 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.825 -1.079 . . . . 0.0 111.923 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.5 t -76.0 -44.15 40.89 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.993 0.517 . . . . 0.0 110.451 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 87.5 t -68.57 -27.78 37.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.004 0.522 . . . . 0.0 110.229 177.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -69.89 -37.83 76.16 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.002 0.521 . . . . 0.0 110.706 173.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.22 -51.06 16.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.448 0.699 . . . . 0.0 111.74 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -89.28 -13.95 36.92 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 111.14 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.81 -20.71 70.23 Favored Glycine 0 C--N 1.349 1.255 0 CA-C-N 116.473 -0.33 . . . . 0.0 113.164 178.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.6 p -72.19 -10.87 60.36 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.915 0.486 . . . . 0.0 111.263 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.7 t -84.02 172.91 11.59 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.681 0.792 . . . . 0.0 110.179 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -148.29 24.94 1.01 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.782 0.833 . . . . 0.0 109.064 175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -73.94 83.0 1.71 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.589 0.756 . . . . 0.0 110.794 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 47.1 t -89.53 120.63 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.722 0.809 . . . . 0.0 110.617 -176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 68.3 mttm -93.04 113.54 25.83 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.392 1.077 . . . . 0.0 108.708 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -73.13 96.1 2.16 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.766 0.794 . . . . 0.0 109.938 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -92.27 -7.77 47.14 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.849 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.3 p -60.18 159.21 10.06 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.373 1.069 . . . . 0.0 111.178 172.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 98.82 19.69 21.34 Favored Glycine 0 N--CA 1.47 0.952 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.446 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 41.8 t -82.28 112.87 19.66 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.185 0.594 . . . . 0.0 109.695 174.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 123.558 0.743 . . . . 0.0 109.021 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 112.174 -0.371 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.2 m -100.48 143.49 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.672 0.789 . . . . 0.0 109.945 175.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.8 pt -73.69 99.02 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-O 121.623 0.725 . . . . 0.0 109.513 173.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 56.2 mtm -81.6 96.5 7.5 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.792 -177.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.88 74.68 1.49 Allowed 'General case' 0 C--O 1.239 0.537 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 168.61 155.61 9.75 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 116.079 -0.509 . . . . 0.0 113.176 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -140.1 158.38 44.15 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.877 1.271 . . . . 0.0 109.526 -176.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.451 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 66.2 m-85 -98.85 146.94 25.43 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.636 0.775 . . . . 0.0 109.43 173.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -133.55 111.57 10.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.619 0.768 . . . . 0.0 109.122 174.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -80.3 95.94 6.49 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 173.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -104.27 -177.38 3.35 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.003 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 29' ' ' ASN . 22.0 ptmt -135.01 146.45 49.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.136 0.574 . . . . 0.0 109.657 174.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.4 m -78.12 169.72 17.8 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.54 0.736 . . . . 0.0 110.344 170.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.52 -10.98 59.12 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.101 0.56 . . . . 0.0 111.177 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -86.87 8.58 22.36 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.059 0.943 . . . . 0.0 111.569 173.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.504 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 42.3 m-80 69.46 7.94 6.5 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.482 1.513 . . . . 0.0 112.88 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HB2' HD12 ' A' ' 48' ' ' LEU . 11.6 mm-40 -84.74 137.59 33.12 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.001 0.52 . . . . 0.0 110.086 -178.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -91.72 134.05 35.06 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.978 0.911 . . . . 0.0 109.854 -172.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -152.87 141.26 20.65 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.625 0.77 . . . . 0.0 108.967 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -98.59 141.06 31.91 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 28.8 m -113.04 133.37 59.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 172.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.5 OUTLIER -88.0 108.04 19.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 167.645 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 4.3 ttmp? -111.54 114.86 28.22 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.155 0.982 . . . . 0.0 109.657 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.42 173.21 2.17 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.173 0.989 . . . . 0.0 112.602 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.15 -15.91 61.47 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.511 -0.768 . . . . 0.0 113.511 -178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -74.83 -6.06 46.95 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.059 0.944 . . . . 0.0 111.671 176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.74 14.94 80.34 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 -176.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -117.36 137.45 52.45 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.049 0.94 . . . . 0.0 109.97 -177.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 60.8 m -76.82 121.64 23.66 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.364 0.666 . . . . 0.0 110.401 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.5 pt -89.49 -19.84 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.008 0.923 . . . . 0.0 110.843 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.8 tp -159.89 118.37 2.73 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -172.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 55.4 m -111.31 127.35 55.61 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.457 0.703 . . . . 0.0 109.377 175.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.9 t -81.56 170.2 16.16 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.603 0.361 . . . . 0.0 111.13 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -83.22 -175.77 5.99 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.725 0.774 . . . . 0.0 112.649 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.476 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.5 mm? -85.5 113.62 21.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.753 -172.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.435 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 75.8 m-85 -107.26 119.58 39.8 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.825 0.85 . . . . 0.0 108.721 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 81.4 p -61.71 -33.48 74.1 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.561 0.744 . . . . 0.0 111.644 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -113.75 135.8 53.55 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 124.095 0.958 . . . . 0.0 109.092 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.32 -28.15 67.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.452 0.701 . . . . 0.0 111.126 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.8 p -57.39 -36.21 70.98 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.074 0.95 . . . . 0.0 111.698 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 24.9 m -71.45 -28.85 64.25 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.252 0.621 . . . . 0.0 111.407 177.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.56 -32.11 57.96 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.608 0.763 . . . . 0.0 111.29 173.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -73.4 -34.07 65.32 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.597 0.759 . . . . 0.0 110.577 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -78.09 -26.34 48.06 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.701 170.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.39 -41.91 94.19 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.361 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.495 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -71.99 -32.41 43.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 175.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.22 -32.91 74.42 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.752 0.421 . . . . 0.0 110.738 172.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.2 m -69.3 -53.74 18.18 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.381 176.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.495 HG22 ' HA ' ' A' ' 59' ' ' ILE . 16.4 m -63.9 -29.1 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 123.047 0.217 . . . . 0.0 111.269 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -55.85 17.6 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.827 0.851 . . . . 0.0 108.728 178.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.9 t -66.52 -23.6 66.26 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.333 -178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.19 4.7 46.84 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.962 0.905 . . . . 0.0 112.28 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 20.1 m -66.76 -48.12 53.51 Favored Pre-proline 0 CA--C 1.565 1.531 0 CA-C-O 118.416 -0.802 . . . . 0.0 111.254 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.95 -16.1 23.23 Favored 'Trans proline' 0 C--N 1.398 3.134 0 C-N-CA 121.814 1.676 . . . . 0.0 112.728 174.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -84.63 99.84 11.05 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.211 0.604 . . . . 0.0 110.394 -178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.67 -23.42 65.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.929 0.891 . . . . 0.0 112.535 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -73.3 -30.18 63.21 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.149 0.979 . . . . 0.0 110.615 -176.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -75.97 -12.04 60.07 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.41 0.684 . . . . 0.0 112.055 -171.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -129.17 145.77 51.24 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.579 0.351 . . . . 0.0 110.282 172.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.424 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 36.8 tt0 -130.7 147.24 52.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.531 0.732 . . . . 0.0 109.875 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.06 112.57 5.76 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 74.7 mmtt -111.9 142.04 44.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.666 0.787 . . . . 0.0 111.459 -172.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 55.4 m -123.55 117.63 25.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.452 0.701 . . . . 0.0 109.352 176.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.04 168.4 6.61 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.375 1.07 . . . . 0.0 112.232 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.3 m -64.56 -24.45 67.6 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.223 1.009 . . . . 0.0 112.079 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.47 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 14.7 m120 -89.21 9.78 24.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 0.0 111.337 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.0 5.43 89.74 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 116.499 -0.318 . . . . 0.0 113.326 -178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 73.2 mmtt -73.36 152.56 40.82 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.473 0.709 . . . . 0.0 110.311 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.413 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 92.7 m-85 -113.27 126.73 55.73 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.303 0.641 . . . . 0.0 109.989 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.83 -179.92 8.07 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.066 1.346 . . . . 0.0 108.295 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -139.38 172.26 13.07 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.989 -0.444 . . . . 0.0 109.948 169.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -145.31 141.9 28.96 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.669 0.388 . . . . 0.0 110.489 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.59 140.11 31.69 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.929 0.892 . . . . 0.0 109.214 177.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -121.78 158.83 27.96 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.66 1.584 . . . . 0.0 110.247 -172.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -128.63 -176.48 3.85 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.831 0.852 . . . . 0.0 110.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.44 -22.02 66.64 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.721 0.808 . . . . 0.0 111.625 175.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -73.24 -16.72 61.4 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.522 1.129 . . . . 0.0 111.315 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 m80 67.15 14.68 9.86 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.324 1.45 . . . . 0.0 111.025 -167.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -88.36 161.76 16.93 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 123.493 0.717 . . . . 0.0 110.269 177.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.3 mm -84.66 104.08 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 114.948 -1.023 . . . . 0.0 108.352 174.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.84 -2.33 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.005 0.522 . . . . 0.0 110.471 173.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.59 146.49 8.88 Favored Glycine 0 C--N 1.341 0.851 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.3 p -156.61 123.48 5.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.173 0.989 . . . . 0.0 108.761 178.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.9 m -72.43 171.89 11.44 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.315 1.046 . . . . 0.0 112.649 -171.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.41 150.7 38.26 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 171.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.62 115.27 12.83 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -100.66 150.34 22.84 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.65 -31.91 52.94 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.388 0.275 . . . . 0.0 110.971 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.3 p -110.81 148.7 31.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.065 0.546 . . . . 0.0 111.778 -174.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.32 -24.4 61.3 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.421 1.089 . . . . 0.0 112.353 -175.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -68.78 -32.91 72.98 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.276 0.631 . . . . 0.0 111.54 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.5 m -68.76 -31.38 70.37 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.015 0.526 . . . . 0.0 112.368 -173.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.413 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 38.6 ptt180 -75.99 -39.75 55.19 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 117.421 0.101 . . . . 0.0 110.875 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -76.91 -28.64 55.39 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.3 m -66.41 -38.4 87.38 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 168.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.35 -37.06 92.49 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.748 174.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.9 mm -59.39 -51.44 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 123.546 0.739 . . . . 0.0 109.572 174.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.79 68.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.671 0.789 . . . . 0.0 111.353 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.3 t -75.52 -33.81 60.75 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.897 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.1 t -70.45 -35.05 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 122.971 0.508 . . . . 0.0 110.235 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -67.53 -34.27 76.74 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.564 0.746 . . . . 0.0 111.053 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.12 -50.17 8.76 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.167 0.587 . . . . 0.0 111.294 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -89.22 -1.77 58.21 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.695 0.798 . . . . 0.0 112.208 -170.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.07 -25.12 76.3 Favored Glycine 0 C--N 1.339 0.721 0 CA-C-O 120.144 -0.254 . . . . 0.0 112.747 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.3 t -89.28 -5.96 57.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.481 0.712 . . . . 0.0 111.38 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.0 m -66.03 143.21 57.5 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.956 0.502 . . . . 0.0 110.684 177.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -111.65 8.21 20.73 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.624 0.769 . . . . 0.0 110.742 -175.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 23.4 m -77.38 91.62 3.87 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.866 0.867 . . . . 0.0 110.792 -175.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.6 t -104.24 113.05 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.609 0.764 . . . . 0.0 109.827 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 43.8 mtpt -101.38 110.27 22.25 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.583 0.753 . . . . 0.0 109.905 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -76.82 94.45 3.88 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-O 122.149 0.976 . . . . 0.0 110.094 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -95.25 7.79 45.08 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.302 1.041 . . . . 0.0 110.707 178.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.5 p -62.65 92.43 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.715 0.806 . . . . 0.0 111.344 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.63 -24.09 10.58 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.109 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 t -73.66 88.68 1.72 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.599 0.76 . . . . 0.0 110.053 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.5 m120 . . . . . 0 C--O 1.25 1.082 0 C-N-CA 124.752 1.221 . . . . 0.0 108.562 -179.219 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.579 0 N-CA-C 112.001 -0.439 . . . . 0.0 112.001 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -83.5 142.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.126 0.57 . . . . 0.0 110.513 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.1 pt -104.42 127.84 58.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 CA-C-O 121.279 0.561 . . . . 0.0 109.497 175.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 56.7 mtt -85.31 97.57 10.03 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.487 0.715 . . . . 0.0 110.428 -172.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.2 88.23 5.53 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.145 0.978 . . . . 0.0 109.023 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.03 147.56 22.11 Favored Glycine 0 C--N 1.34 0.762 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -170.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -159.72 153.79 23.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.469 0.708 . . . . 0.0 110.276 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -100.03 152.09 20.62 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.932 173.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -133.08 114.66 14.17 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.872 0.869 . . . . 0.0 109.18 176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 52' ' ' LYS . 40.8 tp -80.5 98.32 7.52 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -102.45 179.5 4.28 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.448 1.099 . . . . 0.0 109.306 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HE3' ' H ' ' A' ' 127' ' ' GLY . 22.5 pttp -146.48 145.07 30.06 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 168.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.3 m -81.45 -173.35 4.32 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.279 0.632 . . . . 0.0 111.422 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -63.06 -22.6 66.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.799 0.84 . . . . 0.0 111.115 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.26 -16.74 61.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.501 1.12 . . . . 0.0 111.95 174.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 71.58 11.27 6.49 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 125.543 1.537 . . . . 0.0 111.795 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -81.14 138.09 35.91 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.526 0.73 . . . . 0.0 109.102 174.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -89.57 138.36 31.53 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.99 0.916 . . . . 0.0 110.33 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -149.5 130.89 14.71 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.118 0.967 . . . . 0.0 108.99 -168.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -90.77 143.49 26.68 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.77 131.64 71.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 166.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.26 110.18 22.41 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -98.39 123.51 42.56 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 171.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.4 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.96 178.87 0.75 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.578 0.751 . . . . 0.0 111.478 176.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.91 -20.83 54.35 Favored Glycine 0 CA--C 1.54 1.65 0 CA-C-O 121.105 0.28 . . . . 0.0 112.652 172.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.82 -23.29 65.16 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.367 1.467 . . . . 0.0 111.993 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.16 -3.86 82.58 Favored Glycine 0 C--N 1.35 1.31 0 C-N-CA 123.307 0.48 . . . . 0.0 112.521 -173.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -88.28 134.08 33.89 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.775 1.23 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.7 m -71.85 120.53 17.58 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 173.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.4 HD13 ' HB2' ' A' ' 37' ' ' ALA . 28.3 pt -108.3 -25.55 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 125.041 1.337 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.423 HD13 HG21 ' A' ' 113' ' ' VAL . 16.4 tp -140.32 151.42 45.03 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.286 1.034 . . . . 0.0 108.552 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 86.0 m -151.01 110.62 4.02 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.097 0.959 . . . . 0.0 108.649 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.448 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 18.8 m -63.57 165.32 8.22 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.314 0.646 . . . . 0.0 110.942 175.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.96 179.82 4.71 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.283 0.563 . . . . 0.0 111.414 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.74 114.75 22.94 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 175.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -106.17 142.39 35.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.197 0.999 . . . . 0.0 109.384 -178.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.0 t -65.52 -26.72 68.03 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.407 0.683 . . . . 0.0 111.454 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -139.41 150.42 45.24 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.01 0.924 . . . . 0.0 109.559 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.601 ' HB2' HD21 ' A' ' 23' ' ' LEU . 20.3 pttm -62.67 -26.57 68.72 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.613 0.571 . . . . 0.0 110.841 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.439 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 82.1 p -50.97 -47.36 61.31 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.091 1.357 . . . . 0.0 112.122 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.2 m -71.71 -26.63 62.57 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.74 . . . . 0.0 111.552 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.35 -35.75 63.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.616 0.767 . . . . 0.0 110.23 174.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.83 -37.82 76.34 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.097 0.959 . . . . 0.0 110.206 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 53' ' ' THR . 29.2 mtpp -66.47 -33.53 75.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.608 170.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.06 -49.78 74.62 Favored Glycine 0 C--N 1.35 1.339 0 O-C-N 124.071 0.857 . . . . 0.0 112.762 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.508 ' HA ' HG22 ' A' ' 62' ' ' VAL . 11.0 tt -70.42 -36.11 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 117.15 0.475 . . . . 0.0 110.9 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.54 -39.33 79.9 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.114 0.483 . . . . 0.0 110.301 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.1 m -74.47 -43.28 56.82 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.858 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.508 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -66.1 -28.79 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 119.11 0.868 . . . . 0.0 110.319 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.4 tpt85 -68.16 -39.23 82.65 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.678 0.791 . . . . 0.0 109.869 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 41.7 m -78.35 -24.05 46.65 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.691 0.796 . . . . 0.0 111.509 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -105.32 13.69 30.02 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.107 0.963 . . . . 0.0 111.21 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.9 m -55.93 -45.36 99.91 Favored Pre-proline 0 CA--C 1.569 1.676 0 C-N-CA 123.591 0.756 . . . . 0.0 112.148 172.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -87.93 -14.09 3.63 Favored 'Trans proline' 0 C--N 1.396 3.032 0 C-N-CA 121.796 1.664 . . . . 0.0 113.951 175.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.38 93.12 4.02 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.033 0.533 . . . . 0.0 110.769 -170.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.09 -32.37 72.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.948 1.299 . . . . 0.0 112.565 -173.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -68.85 -26.04 64.95 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.551 0.74 . . . . 0.0 111.041 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -77.06 -26.05 53.13 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.572 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.468 ' HB3' HD12 ' A' ' 110' ' ' ILE . 95.9 m-85 -82.58 97.12 8.31 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 171.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -110.28 146.42 35.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.83 0.452 . . . . 0.0 109.888 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -87.01 149.32 24.84 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.798 1.239 . . . . 0.0 109.469 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -155.77 129.15 8.28 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.209 0.603 . . . . 0.0 109.857 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 48.2 m -92.27 121.42 33.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.954 0.502 . . . . 0.0 109.658 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -59.47 160.98 6.24 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.248 1.019 . . . . 0.0 111.908 174.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.2 t -72.37 -9.99 59.21 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.803 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -72.44 -10.32 59.65 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.744 0.818 . . . . 0.0 111.199 168.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.47 -6.05 84.02 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.35 0.5 . . . . 0.0 112.523 -175.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -92.28 159.15 15.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.735 0.814 . . . . 0.0 110.333 -174.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -105.75 128.89 53.97 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 -166.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.48 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 26.5 p90 -139.2 177.83 7.62 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -123.76 171.27 9.75 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.086 0.47 . . . . 0.0 110.07 176.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.42 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -148.08 121.78 9.24 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 124.154 0.981 . . . . 0.0 108.434 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.536 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -83.64 97.99 9.38 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 178.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -84.46 145.7 28.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.324 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -110.99 170.78 7.87 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.624 0.769 . . . . 0.0 110.839 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.29 -9.4 53.03 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.889 0.876 . . . . 0.0 111.673 173.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -88.01 6.26 36.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.229 1.011 . . . . 0.0 111.883 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 77.4 m80 69.92 -2.74 1.93 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 125.058 1.343 . . . . 0.0 112.34 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -99.06 150.98 21.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.432 0.693 . . . . 0.0 109.626 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.599 HG21 ' HB3' ' A' ' 96' ' ' SER . 50.4 mt -87.52 108.92 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 173.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.536 HD11 HD22 ' A' ' 86' ' ' LEU . 9.9 pt -79.32 -5.83 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.729 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . 178.67 113.91 0.39 Allowed Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 173.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.599 ' HB3' HG21 ' A' ' 93' ' ' ILE . 52.5 p -112.33 151.22 29.98 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.917 0.858 . . . . 0.0 109.743 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.9 t -81.11 166.49 20.65 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.31 -78.02 0.15 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.15 0.58 . . . . 0.0 109.87 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.48 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 23.3 ptm -175.75 122.51 0.19 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.283 1.033 . . . . 0.0 108.943 -176.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -102.97 115.86 31.43 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 172.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.97 90.9 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.039 0.536 . . . . 0.0 110.207 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.0 p -90.23 120.05 31.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.847 0.859 . . . . 0.0 109.226 172.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -24.64 65.9 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.207 1.003 . . . . 0.0 113.114 -171.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -65.94 -29.39 69.8 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.239 0.616 . . . . 0.0 111.868 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.8 m -71.77 -21.22 61.76 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.871 0.868 . . . . 0.0 111.417 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.72 -40.64 88.48 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.486 0.714 . . . . 0.0 109.529 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.86 -47.38 85.3 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.359 1.063 . . . . 0.0 110.919 174.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.1 m -60.75 -36.52 79.11 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.193 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -62.44 -42.53 99.7 Favored Glycine 0 C--N 1.35 1.311 0 O-C-N 123.627 0.58 . . . . 0.0 112.881 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.468 HD12 ' HB3' ' A' ' 72' ' ' TYR . 32.5 mm -58.09 -47.1 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.197 0.599 . . . . 0.0 110.145 175.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.87 -32.3 72.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.207 1.003 . . . . 0.0 111.602 -178.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 9.0 t -74.2 -41.53 61.25 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.274 0.63 . . . . 0.0 110.306 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.423 HG21 HD13 ' A' ' 44' ' ' LEU . 94.1 t -75.91 -26.34 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.192 0.597 . . . . 0.0 110.684 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -64.41 -39.79 94.52 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.204 0.602 . . . . 0.0 109.845 169.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -77.1 -47.02 21.61 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.128 0.971 . . . . 0.0 111.878 -177.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -101.58 -2.72 29.85 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.674 0.79 . . . . 0.0 112.195 -170.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -75.91 -8.88 85.12 Favored Glycine 0 N--CA 1.475 1.287 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 82.7 p -80.25 -12.84 59.58 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.28 1.032 . . . . 0.0 111.567 174.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.8 m -69.97 118.23 12.55 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.904 0.882 . . . . 0.0 110.733 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -82.94 -17.71 42.65 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.409 0.683 . . . . 0.0 110.766 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.4 m -61.93 92.62 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.942 0.897 . . . . 0.0 112.425 -174.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 84.0 t -88.53 101.39 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.688 170.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -87.21 143.78 27.13 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 169.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -104.73 138.77 40.52 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.278 0.561 . . . . 0.0 110.819 -178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -129.94 -2.31 4.65 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.736 1.214 . . . . 0.0 109.912 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 37.1 p -70.32 131.47 44.19 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . 0.425 ' H ' ' HE3' ' A' ' 25' ' ' LYS . . . 81.6 14.73 77.52 Favored Glycine 0 C--N 1.341 0.812 0 CA-C-O 119.647 -0.529 . . . . 0.0 112.855 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.8 t -67.78 132.48 47.51 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.9 p30 . . . . . 0 CA--C 1.558 1.268 0 C-N-CA 123.326 0.651 . . . . 0.0 111.406 -173.61 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.408 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.9 m -72.96 153.89 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.156 0.582 . . . . 0.0 110.542 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.2 pt -79.24 156.94 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 122.961 0.504 . . . . 0.0 110.817 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.7 mmt -74.9 98.8 3.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.14 96.98 4.61 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.534 0.734 . . . . 0.0 109.938 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.469 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . 163.92 168.83 26.57 Favored Glycine 0 C--N 1.342 0.864 0 O-C-N 123.682 0.614 . . . . 0.0 112.136 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.468 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.2 p90 -154.76 168.84 25.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.677 0.791 . . . . 0.0 111.103 -171.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 46.1 m-85 -110.57 148.8 31.42 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.67 1.188 . . . . 0.0 108.438 172.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.585 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 39.3 mt-10 -133.39 111.28 10.64 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 171.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 31' ' ' PHE . 26.9 tp -83.37 100.29 10.59 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.417 0.627 . . . . 0.0 109.606 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 m -93.83 178.41 5.68 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.688 1.195 . . . . 0.0 110.051 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -130.37 163.13 27.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.554 0.742 . . . . 0.0 109.442 173.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -120.98 -169.46 1.84 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.763 0.825 . . . . 0.0 110.523 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.0 m -63.46 -30.43 71.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.96 0.904 . . . . 0.0 112.657 -170.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -89.0 12.51 15.27 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.146 0.578 . . . . 0.0 111.267 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.6 t30 63.36 20.91 12.53 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.046 1.339 . . . . 0.0 110.48 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.23 142.08 28.17 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.732 0.813 . . . . 0.0 110.169 -178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.491 ' HB3' HD11 ' A' ' 23' ' ' LEU . 79.7 m-85 -90.96 130.71 36.86 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 124.905 1.282 . . . . 0.0 110.742 -165.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 46' ' ' SER . 47.5 ttm-85 -134.88 127.34 30.52 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.749 1.22 . . . . 0.0 108.611 -174.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.97 135.16 33.81 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.5 m -113.96 131.31 66.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 165.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.428 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.6 OUTLIER -104.56 115.66 30.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -113.92 138.88 49.73 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.506 0.722 . . . . 0.0 109.684 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 174.4 11.63 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.217 0.607 . . . . 0.0 109.941 170.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.84 -14.78 68.25 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.972 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -70.8 -11.56 61.03 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.722 1.209 . . . . 0.0 111.478 174.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 88.4 0.5 82.32 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.908 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -96.42 141.73 29.37 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.699 0.799 . . . . 0.0 110.997 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.4 m -79.1 119.89 22.86 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.011 0.819 . . . . 0.0 109.335 175.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.403 HD11 HD22 ' A' ' 35' ' ' LEU . 26.2 pt -92.35 -30.53 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.271 1.028 . . . . 0.0 111.106 -178.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.4 tp -148.55 150.59 33.62 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.808 0.843 . . . . 0.0 109.131 -176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.474 HG22 HH11 ' A' ' 32' ' ' ARG . 55.6 m -136.31 109.92 8.03 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.493 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 13.2 m -66.83 153.3 43.75 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.449 0.7 . . . . 0.0 109.682 173.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -82.89 -167.91 1.84 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.117 0.567 . . . . 0.0 112.195 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -77.18 145.21 37.8 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.464 0.706 . . . . 0.0 111.731 -173.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 96.2 m-85 -134.65 133.61 40.29 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.35 1.46 . . . . 0.0 107.732 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.4 m -61.39 -36.94 81.68 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.123 0.569 . . . . 0.0 110.707 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.6 m -126.31 150.68 48.34 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.333 178.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -67.99 -24.51 65.14 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.349 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.7 p -62.17 -36.34 81.57 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.45 0.7 . . . . 0.0 111.464 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.7 m -69.63 -35.38 75.18 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.229 0.612 . . . . 0.0 109.974 173.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.0 69.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.778 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -67.84 -34.82 77.45 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.25 0.62 . . . . 0.0 110.303 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -67.14 -35.88 80.67 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.099 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.21 -49.33 71.97 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 123.925 0.766 . . . . 0.0 113.337 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.5 tt -67.74 -33.68 63.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 116.961 0.38 . . . . 0.0 111.008 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.19 -37.61 87.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.845 0.458 . . . . 0.0 110.406 175.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.9 m -74.41 -39.5 62.61 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.029 -178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 20.2 m -67.23 -33.41 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 CA-C-N 118.774 0.715 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -73.91 -35.16 64.6 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.894 177.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.6 t -76.25 -21.48 56.29 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.522 0.729 . . . . 0.0 110.673 176.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.565 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 0.9 OUTLIER -95.06 8.33 43.3 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.917 0.887 . . . . 0.0 110.885 176.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 39.8 t -67.49 -47.45 47.15 Favored Pre-proline 0 CA--C 1.572 1.819 0 CA-C-O 118.477 -0.773 . . . . 0.0 110.397 171.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -69.93 -26.37 26.83 Favored 'Trans proline' 0 C--N 1.4 3.263 0 C-N-CA 121.957 1.771 . . . . 0.0 112.142 168.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 65' ' ' ASN . 12.0 mm100 -92.55 46.69 1.26 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.899 0.88 . . . . 0.0 109.191 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -67.44 -13.02 61.65 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -172.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -73.37 -26.04 60.84 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.786 0.834 . . . . 0.0 110.562 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.44 HH21 ' HG2' ' A' ' 73' ' ' GLU . 3.6 tpm_? -70.78 -16.29 62.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.899 0.88 . . . . 0.0 112.269 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -63.46 122.48 16.37 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 168.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HG2' HH21 ' A' ' 71' ' ' ARG . 38.0 mt-10 -94.6 110.92 22.7 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -172.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.03 104.31 1.11 Allowed 'General case' 0 C--N 1.353 0.741 0 O-C-N 123.9 0.75 . . . . 0.0 110.062 -178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -95.37 143.93 26.33 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.664 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.5 m -127.24 115.43 19.03 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 172.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.74 155.48 37.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.674 0.79 . . . . 0.0 110.573 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.9 t -68.63 -13.12 62.14 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.53 0.732 . . . . 0.0 110.685 175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -77.31 4.65 10.22 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.024 0.929 . . . . 0.0 111.713 172.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.21 17.86 77.67 Favored Glycine 0 C--N 1.351 1.413 0 C-N-CA 122.885 0.278 . . . . 0.0 113.089 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -104.7 125.8 51.15 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.831 0.852 . . . . 0.0 110.274 -176.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -79.7 137.42 37.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 172.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -150.83 176.81 10.71 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 169.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -138.21 140.82 39.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 122.048 -0.408 . . . . 0.0 110.483 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -110.74 114.34 27.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 171.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -80.73 125.29 29.87 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -109.58 138.99 45.13 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.071 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.22 161.81 13.95 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.44 0.696 . . . . 0.0 110.685 175.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.72 69.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.921 0.888 . . . . 0.0 111.323 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.41 12.26 3.81 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.555 1.142 . . . . 0.0 112.539 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 66.35 14.11 9.53 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.853 1.261 . . . . 0.0 111.677 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -88.9 128.85 35.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.494 0.718 . . . . 0.0 109.135 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.8 96.91 1.86 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.7 pt -83.46 -7.07 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.081 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -162.59 145.18 10.36 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 173.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.9 p -155.45 118.78 4.4 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.3 t -81.76 164.42 21.71 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 122.758 0.423 . . . . 0.0 110.615 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -75.02 -84.59 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 123.119 0.568 . . . . 0.0 110.085 -176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 12.7 ptp -164.55 129.73 2.74 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.975 0.91 . . . . 0.0 109.504 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 81.0 m-85 -104.25 131.76 51.22 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.649 0.78 . . . . 0.0 109.719 173.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.37 -31.37 72.02 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.958 0.903 . . . . 0.0 111.645 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 17.5 p -140.81 165.64 26.96 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.976 0.91 . . . . 0.0 110.557 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -30.7 69.53 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.399 1.08 . . . . 0.0 112.065 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -61.11 -37.44 82.8 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 123.953 0.783 . . . . 0.0 111.385 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.485 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 21.5 m -74.58 -30.78 61.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.01 0.924 . . . . 0.0 110.569 -178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -39.4 88.69 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.085 0.954 . . . . 0.0 110.089 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -69.43 -36.93 77.14 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.795 0.838 . . . . 0.0 110.71 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.0 m -62.86 -37.63 87.63 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.529 0.732 . . . . 0.0 109.482 172.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.432 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.92 -48.56 82.84 Favored Glycine 0 C--N 1.35 1.317 0 CA-C-N 115.357 -0.838 . . . . 0.0 112.427 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.0 mm -55.23 -50.01 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.331 0.652 . . . . 0.0 110.095 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.69 -39.35 84.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 13.7 t -76.15 -36.01 58.95 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.86 -175.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 109' ' ' GLY . 85.5 t -71.16 -31.9 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-N 118.141 0.428 . . . . 0.0 110.198 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -69.23 -43.37 74.19 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.633 0.373 . . . . 0.0 110.766 174.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.71 -48.15 56.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.565 0.746 . . . . 0.0 111.327 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.469 ' ND2' ' HA3' ' A' ' 19' ' ' GLY . 22.4 m120 -88.8 -10.54 47.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.874 0.87 . . . . 0.0 111.576 -175.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.44 -37.15 89.93 Favored Glycine 0 C--N 1.346 1.136 0 O-C-N 123.245 0.341 . . . . 0.0 112.785 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.1 t -75.78 -11.14 59.93 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.934 0.894 . . . . 0.0 112.239 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.2 m -69.5 104.56 2.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.179 0.592 . . . . 0.0 110.135 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -86.28 72.47 10.35 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.222 1.011 . . . . 0.0 108.802 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.468 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.1 t -145.42 93.83 2.43 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.041 -1.436 . . . . 0.0 108.898 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 94.2 t -109.24 123.79 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.974 0.91 . . . . 0.0 110.542 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.585 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -100.7 90.26 4.18 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 174.289 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.94 97.16 1.8 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.405 ' ND2' ' HB3' ' A' ' 22' ' ' GLU . 87.2 m-20 -84.54 -4.12 58.79 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.561 1.144 . . . . 0.0 112.445 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.416 HG21 ' HD1' ' A' ' 31' ' ' PHE . 47.3 p -68.53 153.28 44.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.315 0.646 . . . . 0.0 111.202 -176.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 102.96 -19.44 46.7 Favored Glycine 0 N--CA 1.472 1.093 0 CA-C-O 119.958 -0.357 . . . . 0.0 112.442 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 34.7 p -78.5 127.12 31.71 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.159 0.583 . . . . 0.0 110.016 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.7 m120 . . . . . 0 C--O 1.251 1.158 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -177.011 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.339 -0.304 . . . . 0.0 112.339 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.2 m -112.33 156.57 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.05 0.94 . . . . 0.0 109.448 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.4 pt -85.1 139.99 16.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 63.1 mtt -88.78 106.2 18.21 Favored 'General case' 0 C--O 1.245 0.824 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.73 82.3 2.7 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.228 -0.896 . . . . 0.0 108.868 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.0 154.5 30.6 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.92 -172.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.2 p90 -159.05 150.13 20.12 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.799 0.839 . . . . 0.0 109.88 -178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -90.57 157.48 17.49 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.607 0.763 . . . . 0.0 109.56 172.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.477 ' HA ' ' HB3' ' A' ' 123' ' ' LYS . 55.3 mt-10 -136.09 110.49 8.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.69 0.796 . . . . 0.0 109.565 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.457 HD21 ' HG3' ' A' ' 52' ' ' LYS . 29.2 tp -94.18 101.68 13.68 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.197 0.599 . . . . 0.0 109.849 -178.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.551 ' HA ' ' HB3' ' A' ' 125' ' ' ASN . 22.3 m -107.04 174.49 5.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.239 1.016 . . . . 0.0 110.702 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.39 151.65 36.59 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.199 0.999 . . . . 0.0 109.58 175.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.8 m -89.43 -177.65 5.39 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.771 0.829 . . . . 0.0 111.428 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.6 t -61.92 -34.82 76.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.952 0.901 . . . . 0.0 110.943 175.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.38 11.52 36.33 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.782 0.833 . . . . 0.0 111.078 176.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 t30 69.42 33.78 3.06 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 125.349 1.46 . . . . 0.0 112.559 174.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -81.12 139.27 35.73 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 121.748 -0.595 . . . . 0.0 110.027 170.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -90.16 117.47 28.95 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.393 1.077 . . . . 0.0 109.485 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -130.18 119.29 22.72 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.062 0.945 . . . . 0.0 109.264 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 41.4 p90 -95.24 130.54 41.94 Favored 'General case' 0 C--O 1.241 0.615 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 45' ' ' THR . 20.7 m -106.12 170.75 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 170.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.2 125.27 42.16 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -112.81 138.81 49.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -67.97 178.49 1.78 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.454 0.702 . . . . 0.0 111.305 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -19.86 61.46 Favored Glycine 0 C--N 1.35 1.327 0 CA-C-N 116.585 -0.28 . . . . 0.0 113.031 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -67.8 -24.35 65.29 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.598 0.759 . . . . 0.0 111.779 173.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.37 15.5 58.58 Favored Glycine 0 C--N 1.342 0.915 0 CA-C-N 116.537 -0.302 . . . . 0.0 113.025 -175.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -106.77 141.46 37.98 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.421 0.689 . . . . 0.0 110.317 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.9 m -67.77 122.29 17.79 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 123.602 0.564 . . . . 0.0 110.861 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.5 pt -109.85 -18.47 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.775 1.23 . . . . 0.0 110.651 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 tp -151.06 145.94 25.84 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.498 HG23 HG12 ' A' ' 34' ' ' VAL . 92.5 m -146.4 119.06 8.56 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.842 0.857 . . . . 0.0 108.813 178.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.0 t -82.0 177.26 8.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.919 0.487 . . . . 0.0 111.335 -178.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -73.22 175.43 6.82 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.346 1.059 . . . . 0.0 111.725 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.0 114.65 27.25 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.414 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -99.56 147.33 25.45 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.069 0.948 . . . . 0.0 109.323 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.6 p -81.09 -31.99 34.1 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.83 0.452 . . . . 0.0 111.297 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.2 m -109.15 143.7 38.2 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.953 0.901 . . . . 0.0 109.703 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HG3' HD21 ' A' ' 23' ' ' LEU . 87.3 tttt -67.93 -37.89 82.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 122.978 0.511 . . . . 0.0 110.412 177.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.172 0.989 . . . . 0.0 111.695 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.6 m -64.12 -39.2 93.52 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.072 0.949 . . . . 0.0 111.25 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.97 -34.67 66.61 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.578 0.751 . . . . 0.0 110.886 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.94 -29.63 65.71 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.575 0.75 . . . . 0.0 111.1 177.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -77.96 -27.41 49.23 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.322 0.249 . . . . 0.0 111.275 170.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.85 -40.84 99.37 Favored Glycine 0 C--N 1.344 1.002 0 O-C-N 123.525 0.516 . . . . 0.0 112.827 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.449 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.4 tt -68.01 -32.82 57.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 120.91 0.386 . . . . 0.0 111.067 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.96 -33.17 74.15 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.071 0.548 . . . . 0.0 110.677 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -70.84 -50.83 31.11 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.879 0.871 . . . . 0.0 111.344 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 59' ' ' ILE . 30.7 m -66.18 -28.84 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.293 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -53.16 -50.97 63.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.681 0.793 . . . . 0.0 110.334 -178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -80.79 -31.99 35.54 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.826 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB3' HD11 ' A' ' 86' ' ' LEU . 14.1 m120 -96.06 -8.4 33.6 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 p -65.28 -37.02 17.24 Favored Pre-proline 0 CA--C 1.566 1.584 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -74.13 -7.9 20.37 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.768 1.645 . . . . 0.0 112.993 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -97.79 88.93 4.44 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 122.923 0.489 . . . . 0.0 109.768 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.458 ' HA ' ' HD1' ' A' ' 72' ' ' TYR . 12.2 pt-20 -62.02 -20.19 63.65 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.801 0.84 . . . . 0.0 111.685 176.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -54.3 -40.74 68.2 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.457 1.103 . . . . 0.0 112.044 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -83.69 -9.43 58.86 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.514 0.726 . . . . 0.0 112.095 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 85' ' ' ASN . 88.8 m-85 -84.01 124.65 31.28 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 171.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.445 ' HB2' ' ND2' ' A' ' 85' ' ' ASN . 41.9 mt-10 -95.5 104.11 16.0 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 173.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -73.14 101.77 3.41 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-O 121.731 0.777 . . . . 0.0 109.136 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HE2' ' ND2' ' A' ' 85' ' ' ASN . 65.9 mttm -102.57 165.05 11.31 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.513 1.125 . . . . 0.0 109.937 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.8 m -126.3 112.2 15.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.312 0.645 . . . . 0.0 109.605 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.0 165.54 6.8 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.841 0.856 . . . . 0.0 111.02 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 m -64.3 -16.31 61.92 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.585 0.754 . . . . 0.0 111.98 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -81.35 -2.05 47.75 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.956 0.902 . . . . 0.0 111.986 177.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 77.94 14.97 81.76 Favored Glycine 0 C--N 1.349 1.27 0 C-N-CA 122.831 0.253 . . . . 0.0 112.935 -176.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.64 142.68 29.15 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.886 0.874 . . . . 0.0 109.535 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -101.23 125.48 47.86 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.865 0.466 . . . . 0.0 109.832 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.454 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 35.7 p90 -131.74 170.54 14.67 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.505 ' HB2' ' HB3' ' A' ' 97' ' ' SER . 16.6 m-85 -131.22 166.89 20.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.942 0.497 . . . . 0.0 110.142 -173.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.558 ' ND2' ' HE2' ' A' ' 75' ' ' LYS . 4.0 p30 -149.77 133.06 16.45 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 167.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.409 HD11 ' HB3' ' A' ' 65' ' ' ASN . 27.2 tp -89.78 116.24 27.73 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -96.88 140.47 31.39 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.933 -176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -98.15 166.04 11.6 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.826 0.85 . . . . 0.0 109.748 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.07 -13.84 62.32 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.088 0.555 . . . . 0.0 111.634 176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.478 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 64.4 m-20 -80.1 4.1 18.34 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.816 0.847 . . . . 0.0 111.296 174.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 74.3 m80 67.25 15.46 9.99 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.02 1.328 . . . . 0.0 111.788 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.478 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 13.4 pt20 -97.67 147.02 24.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.194 0.598 . . . . 0.0 110.426 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.7 mt -87.96 99.72 9.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 13.0 pt -81.22 -16.51 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.756 -177.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.83 103.26 0.2 Allowed Glycine 0 C--N 1.35 1.335 0 C-N-CA 121.701 -0.285 . . . . 0.0 113.046 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 85' ' ' ASN . 39.8 t -92.86 113.56 25.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.661 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.505 ' HB3' ' HB2' ' A' ' 84' ' ' PHE . 46.6 t -81.8 135.85 35.43 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -75.43 172.5 12.4 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.454 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.07 118.08 16.6 Favored 'General case' 0 C--N 1.351 0.651 0 CA-C-O 121.801 0.81 . . . . 0.0 112.045 -171.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -93.95 137.09 33.55 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.485 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.16 -56.51 4.58 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.259 0.624 . . . . 0.0 110.818 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 37.3 p -88.26 151.68 22.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.511 0.724 . . . . 0.0 112.241 -171.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.91 -24.84 60.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.407 1.083 . . . . 0.0 111.973 -177.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -65.81 -37.56 86.58 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.5 m -74.75 -18.59 60.47 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.249 1.02 . . . . 0.0 111.816 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -60.75 -48.95 79.46 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 173.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.7 -48.13 23.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.958 0.903 . . . . 0.0 111.043 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.8 m -61.38 -28.72 69.44 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.704 0.802 . . . . 0.0 111.265 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.449 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -66.26 -51.65 42.22 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.744 178.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.7 mm -65.48 -38.07 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 122.843 0.457 . . . . 0.0 110.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.59 -30.57 71.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.961 0.904 . . . . 0.0 111.486 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.91 -50.08 18.08 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 109' ' ' GLY . 66.2 t -62.17 -36.63 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 C-N-CA 122.972 0.509 . . . . 0.0 111.778 -175.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -69.95 -39.44 76.03 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 120.705 0.288 . . . . 0.0 111.337 178.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.48 -41.57 46.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.326 0.651 . . . . 0.0 111.434 -173.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -91.08 -10.77 40.84 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.5 0.72 . . . . 0.0 110.782 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.22 -12.46 84.58 Favored Glycine 0 C--N 1.354 1.542 0 C-N-CA 122.842 0.258 . . . . 0.0 113.572 177.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.2 p -81.92 -18.31 44.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.259 0.623 . . . . 0.0 111.016 172.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.3 m -76.06 90.34 3.04 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 123.449 0.7 . . . . 0.0 110.046 -178.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.446 ' HA ' HD11 ' A' ' 59' ' ' ILE . 11.7 mm100 -82.93 67.75 9.14 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 122.185 0.993 . . . . 0.0 109.597 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 2.6 t -136.65 93.3 2.85 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.0 -1.454 . . . . 0.0 109.244 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 35.4 m -85.93 141.4 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.183 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.477 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 55.5 tptt -97.07 99.3 10.81 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 174.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -72.85 95.24 1.91 Allowed 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.134 -175.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.551 ' HB3' ' HA ' ' A' ' 24' ' ' SER . 26.5 t-20 -79.06 -26.64 43.05 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 165.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 75.1 p -59.83 137.24 58.11 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.35 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 99.18 -19.65 53.23 Favored Glycine 0 CA--C 1.531 1.047 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.932 -174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.1 m -77.9 162.85 26.51 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.24 0.616 . . . . 0.0 111.385 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.632 -0.699 . . . . 0.0 109.575 179.19 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.379 0 N-CA-C 112.097 -0.401 . . . . 0.0 112.097 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m -71.59 140.85 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.136 0.575 . . . . 0.0 110.138 176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.3 pt -73.11 138.35 21.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 51.8 mtt -70.08 96.12 1.03 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.65 92.92 4.84 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.536 -172.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.29 151.11 9.45 Favored Glycine 0 C--N 1.338 0.678 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.74 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.2 p90 -147.65 148.32 30.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.038 0.935 . . . . 0.0 109.936 -176.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -97.17 118.83 34.48 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -95.58 109.02 21.32 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.61 HD21 ' HB2' ' A' ' 52' ' ' LYS . 49.4 tp -79.72 101.47 8.43 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -103.52 139.8 38.37 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.922 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 126' ' ' THR . 14.8 ptmm? -95.44 130.13 42.36 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 170.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.4 m -83.98 -178.49 6.99 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 109.882 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -59.94 -25.76 65.42 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.066 0.546 . . . . 0.0 112.259 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -102.31 25.71 8.61 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.848 0.859 . . . . 0.0 111.086 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 63.88 12.18 6.58 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 125.035 1.334 . . . . 0.0 112.829 -178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -69.44 126.25 29.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.344 0.658 . . . . 0.0 110.941 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.48 119.95 30.37 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.195 0.998 . . . . 0.0 109.475 -170.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HB2' HD13 ' A' ' 48' ' ' LEU . 47.2 ttp85 -147.9 117.78 7.17 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.837 0.855 . . . . 0.0 108.972 -173.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -90.99 128.08 36.67 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.53 HG12 HG23 ' A' ' 45' ' ' THR . 30.5 m -107.06 130.89 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.694 0.797 . . . . 0.0 108.892 173.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.2 tp -89.77 112.93 24.37 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -105.29 129.29 53.68 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.305 1.042 . . . . 0.0 109.059 175.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.31 -176.98 1.99 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.937 0.495 . . . . 0.0 110.995 173.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.41 -15.06 51.39 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 115.434 0.934 . . . . 0.0 115.434 -173.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -79.77 -14.22 58.87 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.473 0.709 . . . . 0.0 111.723 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.09 6.87 78.25 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 -165.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -84.12 117.43 23.46 Favored 'General case' 0 C--N 1.346 0.429 0 C-N-CA 124.465 1.106 . . . . 0.0 109.961 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.7 m -64.93 119.73 11.26 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 171.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.1 pt -104.91 -24.93 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.292 1.037 . . . . 0.0 109.993 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 13.0 tp -145.61 134.26 22.19 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -170.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.53 HG23 HG12 ' A' ' 34' ' ' VAL . 59.7 m -132.74 123.64 26.63 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.759 0.823 . . . . 0.0 108.951 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 t -83.52 -179.29 7.31 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.292 0.637 . . . . 0.0 111.408 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 93' ' ' ILE . 27.1 mm-40 -68.75 170.32 9.68 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.588 0.755 . . . . 0.0 111.643 174.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.463 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.8 mm? -89.65 113.67 25.18 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 171.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.474 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -99.1 152.15 20.17 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 124.42 1.088 . . . . 0.0 109.859 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 65.5 p -82.84 -17.58 43.44 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.515 0.726 . . . . 0.0 110.932 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.0 m -138.23 149.51 45.84 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.114 0.966 . . . . 0.0 110.076 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.61 ' HB2' HD21 ' A' ' 23' ' ' LEU . 3.1 pptp? -71.88 -27.17 62.67 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.194 0.598 . . . . 0.0 110.444 179.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 14.8 t -68.77 -27.86 66.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.989 0.516 . . . . 0.0 111.046 174.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.474 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 14.6 m -69.31 -36.42 76.99 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.034 0.534 . . . . 0.0 109.637 174.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.88 -30.94 67.45 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.167 174.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -64.39 -43.64 93.83 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.883 0.873 . . . . 0.0 110.479 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 53' ' ' THR . 2.8 mmmp? -64.9 -34.05 77.49 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.981 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.63 -49.55 68.3 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.352 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.9 tt -71.4 -32.24 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 122.607 0.363 . . . . 0.0 111.076 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.95 -38.69 86.76 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.158 0.504 . . . . 0.0 109.796 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.6 m -71.48 -43.22 66.97 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.796 178.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 m -62.36 -32.65 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 118.897 0.771 . . . . 0.0 110.608 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.484 HH22 ' N ' ' A' ' 120' ' ' GLN . 14.9 ttm180 -70.39 -40.11 74.15 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.677 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -68.63 -22.28 64.43 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.101 176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.48 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 60.7 m-80 -98.54 -1.94 39.91 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.441 0.696 . . . . 0.0 112.156 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.1 m -63.15 -45.76 85.85 Favored Pre-proline 0 CA--C 1.568 1.663 0 CA-C-O 118.275 -0.869 . . . . 0.0 111.657 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.8 -37.88 8.47 Favored 'Trans proline' 0 C--N 1.398 3.158 0 C-N-CA 121.762 1.641 . . . . 0.0 111.812 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' A' ' 65' ' ' ASN . 9.5 pt20 -98.66 58.28 1.2 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.934 1.35 . . . . 0.0 109.408 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.27 -11.71 34.29 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 113.27 -1.786 . . . . 0.0 112.899 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -68.19 -25.01 65.03 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.868 0.867 . . . . 0.0 111.894 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.69 -15.6 61.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.011 0.524 . . . . 0.0 112.367 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -60.82 127.39 31.36 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -96.92 107.33 19.82 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.506 0.722 . . . . 0.0 111.532 -168.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -73.51 112.0 9.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.034 0.534 . . . . 0.0 109.76 174.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.411 ' HE2' ' OD1' ' A' ' 85' ' ' ASN . 55.1 mtmt -134.36 143.5 47.69 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 171.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.3 m -101.49 133.36 46.26 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.55 0.74 . . . . 0.0 109.71 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.4 11.54 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.121 0.968 . . . . 0.0 111.649 176.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 p -64.47 -25.97 68.23 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.892 0.877 . . . . 0.0 111.473 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -70.02 -23.75 63.17 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.643 0.777 . . . . 0.0 111.332 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.62 30.91 5.97 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.317 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -113.55 125.9 54.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.409 0.683 . . . . 0.0 110.921 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -83.1 128.6 34.63 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.058 0.943 . . . . 0.0 110.391 -170.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -138.37 173.58 11.46 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 55.5 p90 -131.09 135.53 47.59 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 172.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.411 ' OD1' ' HE2' ' A' ' 75' ' ' LYS . 5.2 p-10 -115.51 129.51 56.56 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -91.69 99.38 12.29 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 173.362 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -106.55 135.97 47.13 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.216 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.472 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -100.85 170.71 8.13 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.33 1.052 . . . . 0.0 111.052 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.11 -8.95 13.72 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.509 0.723 . . . . 0.0 112.936 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.463 HD22 ' N ' ' A' ' 90' ' ' ASN . 0.7 OUTLIER -84.65 7.87 18.86 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.082 0.953 . . . . 0.0 111.311 175.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 87' ' ' LYS . 30.7 m170 63.97 21.94 12.79 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 124.971 1.309 . . . . 0.0 111.687 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -116.82 129.85 56.34 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.831 0.853 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 96' ' ' SER . 40.0 mt -74.05 100.73 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 122.076 0.941 . . . . 0.0 109.519 173.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 86' ' ' LEU . 16.2 pt -75.66 -6.57 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.279 -176.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.01 99.14 0.13 Allowed Glycine 0 C--N 1.353 1.491 0 CA-C-O 120.082 -0.288 . . . . 0.0 112.528 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.576 ' HB3' HG21 ' A' ' 93' ' ' ILE . 34.3 p -92.45 116.77 29.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.4 t -69.39 164.5 22.84 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 122.975 0.51 . . . . 0.0 111.248 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -73.0 156.12 39.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.54 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 67.7 mtm -72.9 116.97 14.05 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -90.63 143.5 26.68 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 124.003 0.921 . . . . 0.0 109.17 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.04 -39.38 79.23 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.021 0.528 . . . . 0.0 110.675 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 65.3 p -117.16 150.24 39.03 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.696 0.798 . . . . 0.0 110.949 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 106' ' ' ARG . . . -69.78 -25.77 63.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.052 0.941 . . . . 0.0 111.909 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -68.86 -29.98 68.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.686 0.394 . . . . 0.0 111.535 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.6 m -71.27 -23.99 62.07 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.123 0.569 . . . . 0.0 111.318 178.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.436 ' O ' HG12 ' A' ' 110' ' ' ILE . 13.1 ttt180 -61.34 -49.55 76.53 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.203 0.601 . . . . 0.0 109.754 169.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.31 -38.11 88.14 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.155 0.982 . . . . 0.0 111.223 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 48.4 m -66.32 -37.28 85.02 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.178 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.33 -35.84 88.37 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.903 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 106' ' ' ARG . 43.6 mm -59.83 -46.67 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.02 -35.66 81.88 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.831 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.6 t -71.1 -42.93 68.65 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.708 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.92 -27.08 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.506 0.723 . . . . 0.0 111.058 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.2 tmtm? -66.04 -47.42 74.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.011 0.925 . . . . 0.0 108.997 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.39 -47.69 22.39 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.647 -177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.461 ' HB3' HD11 ' A' ' 35' ' ' LEU . 77.9 m-20 -83.66 -14.37 51.98 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.51 0.724 . . . . 0.0 111.952 -173.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -70.62 -30.57 68.53 Favored Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.104 -0.399 . . . . 0.0 112.104 173.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.9 p -91.17 9.18 32.18 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.025 0.93 . . . . 0.0 111.343 175.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 31.1 t -103.51 108.68 20.04 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.182 0.993 . . . . 0.0 108.852 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.484 ' N ' HH22 ' A' ' 63' ' ' ARG . 48.5 tt0 -92.82 38.66 1.03 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.276 0.63 . . . . 0.0 111.108 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.3 m -79.26 75.72 5.82 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 171.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 t -91.04 97.5 7.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -77.54 125.55 29.52 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.652 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -77.47 95.17 4.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 172.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -87.32 -0.75 57.23 Favored 'General case' 0 CA--C 1.559 1.317 0 CA-C-O 121.595 0.712 . . . . 0.0 109.44 174.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.424 HG22 ' HB3' ' A' ' 25' ' ' LYS . 25.9 p -72.53 116.81 13.44 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 169.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 87.9 25.68 31.37 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-N 116.606 -0.27 . . . . 0.0 113.023 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.1 m -78.49 82.24 4.77 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.606 0.762 . . . . 0.0 109.186 174.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 CA--C 1.558 1.274 0 C-N-CA 123.118 0.567 . . . . 0.0 111.139 -177.107 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.337 0 N-CA-C 112.002 -0.439 . . . . 0.0 112.002 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -81.25 157.26 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.443 0.697 . . . . 0.0 110.429 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.6 pt -81.58 161.04 3.78 Favored 'Isoleucine or valine' 0 C--O 1.248 1.017 0 C-N-CA 123.182 0.593 . . . . 0.0 110.334 175.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -73.3 110.12 7.35 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 173.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.426 ' HB1' ' HA3' ' A' ' 38' ' ' GLY . . . -71.17 83.59 0.73 Allowed 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.175 0.59 . . . . 0.0 110.047 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 174.03 149.22 6.91 Favored Glycine 0 C--N 1.34 0.754 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.802 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 48.3 p90 -145.16 150.06 36.08 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.413 1.085 . . . . 0.0 110.186 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -95.34 153.03 17.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.843 0.857 . . . . 0.0 109.46 173.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 84.3 mt-10 -133.32 109.77 9.6 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.5 tp -82.01 102.0 10.69 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -101.11 -177.63 3.51 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.432 1.093 . . . . 0.0 109.507 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.508 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 18.7 ptpt -138.71 165.9 25.77 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.041 0.536 . . . . 0.0 109.757 169.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 19.3 t -100.55 -174.07 2.56 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.861 0.864 . . . . 0.0 108.878 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.5 t -62.28 -35.28 78.53 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.458 0.703 . . . . 0.0 111.525 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -90.79 26.37 2.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.154 0.582 . . . . 0.0 111.532 178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.508 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 90.2 m-20 62.99 19.22 11.5 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.536 1.134 . . . . 0.0 112.263 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -71.52 116.5 11.94 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.671 0.788 . . . . 0.0 109.731 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.5 120.61 28.02 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.001 0.521 . . . . 0.0 110.06 -168.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.3 ttt85 -142.51 116.25 9.23 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.028 1.331 . . . . 0.0 108.116 -170.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -102.91 145.83 29.23 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.241 0.544 . . . . 0.0 110.597 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.573 HG12 HG23 ' A' ' 45' ' ' THR . 29.5 m -106.86 171.4 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.382 1.073 . . . . 0.0 108.789 175.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 24.3 tp -137.54 109.56 7.21 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 173.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 65.5 mttm -95.14 141.93 28.18 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 178.05 7.01 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 168.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' HA3' ' HB1' ' A' ' 18' ' ' ALA . . . -64.52 -18.22 63.21 Favored Glycine 0 N--CA 1.48 1.596 0 C-N-CA 122.898 0.285 . . . . 0.0 113.035 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -63.73 -21.57 66.47 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 125.156 1.382 . . . . 0.0 111.89 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.82 2.22 75.66 Favored Glycine 0 C--N 1.35 1.354 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -173.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -98.35 130.43 45.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.918 1.287 . . . . 0.0 109.818 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 30.4 m -72.34 121.47 19.53 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.391 0.615 . . . . 0.0 110.532 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.8 pt -99.99 -24.37 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.92 1.288 . . . . 0.0 111.5 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -146.1 143.62 29.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.573 HG23 HG12 ' A' ' 34' ' ' VAL . 48.2 m -146.15 114.48 6.68 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.308 0.643 . . . . 0.0 109.71 177.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.2 m -69.39 164.29 23.3 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.931 0.892 . . . . 0.0 111.347 178.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -83.39 178.19 8.15 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.394 0.616 . . . . 0.0 111.948 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.57 113.36 11.74 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.644 -1.162 . . . . 0.0 109.222 -177.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.76 156.78 16.18 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.006 0.922 . . . . 0.0 109.002 171.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.7 m -82.31 -24.47 34.61 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 173.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.7 t -126.61 146.87 50.0 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.365 0.666 . . . . 0.0 111.316 -174.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.5 ' HD3' ' H ' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -75.08 -27.84 60.09 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.207 176.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.7 m -63.49 -38.42 91.07 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.54 1.536 . . . . 0.0 110.925 172.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.3 m -65.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.551 0.74 . . . . 0.0 110.606 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.31 -30.81 57.87 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.158 0.983 . . . . 0.0 111.92 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -73.98 -38.08 64.26 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.516 0.726 . . . . 0.0 110.143 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -22.79 52.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.248 169.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.97 93.36 Favored Glycine 0 C--N 1.349 1.281 0 O-C-N 123.745 0.653 . . . . 0.0 112.655 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.494 ' HA ' HG22 ' A' ' 62' ' ' VAL . 5.7 tt -65.55 -36.06 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 122.341 0.256 . . . . 0.0 110.37 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -35.76 81.56 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.074 0.55 . . . . 0.0 110.893 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.9 m -73.7 -43.84 58.17 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.57 0.748 . . . . 0.0 111.621 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.494 HG22 ' HA ' ' A' ' 59' ' ' ILE . 18.8 m -70.11 -29.11 38.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 110.181 -0.304 . . . . 0.0 110.181 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -67.89 -45.14 75.33 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.919 0.888 . . . . 0.0 108.887 176.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 42.6 t -64.97 -15.79 62.63 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.076 0.95 . . . . 0.0 111.892 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -123.99 18.47 9.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.443 0.697 . . . . 0.0 112.392 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.9 m -63.19 -45.85 85.67 Favored Pre-proline 0 CA--C 1.567 1.619 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.195 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.64 -12.81 11.03 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 121.614 1.543 . . . . 0.0 113.093 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -75.98 84.66 2.88 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 121.484 0.659 . . . . 0.0 110.868 -173.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.06 -28.7 70.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.147 1.379 . . . . 0.0 112.045 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -63.24 -35.82 81.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.659 0.783 . . . . 0.0 110.824 174.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' HA ' ' NE ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.19 -19.99 35.48 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.453 -174.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -70.83 106.3 3.55 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 167.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -97.63 107.4 19.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.494 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.99 123.69 43.45 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.118 0.967 . . . . 0.0 109.75 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -132.99 150.65 52.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.844 1.257 . . . . 0.0 109.633 -175.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 19.2 m -92.79 117.26 29.82 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.581 0.752 . . . . 0.0 109.518 171.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.86 163.53 7.46 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.078 0.951 . . . . 0.0 112.235 175.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 t -68.58 -14.68 63.18 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.269 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -82.79 1.87 36.85 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.086 0.955 . . . . 0.0 111.772 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.81 32.91 58.52 Favored Glycine 0 C--N 1.353 1.506 0 C-N-CA 123.121 0.391 . . . . 0.0 112.951 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 74.8 mmtt -122.94 150.28 43.16 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.114 0.965 . . . . 0.0 109.728 -177.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -96.57 126.82 42.02 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.307 0.643 . . . . 0.0 109.987 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -137.79 176.69 8.48 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -141.46 166.14 25.56 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.907 0.483 . . . . 0.0 110.116 173.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -148.51 135.57 20.12 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.694 HD12 HD11 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -88.51 119.41 28.93 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -93.16 139.28 30.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.318 1.047 . . . . 0.0 109.896 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.2 176.1 7.09 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.279 0.632 . . . . 0.0 110.643 177.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.63 -23.71 65.38 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-O 121.448 0.642 . . . . 0.0 110.126 169.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -79.56 -3.81 48.6 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.689 1.196 . . . . 0.0 110.728 174.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.6 m80 65.42 15.57 10.09 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 125.737 1.615 . . . . 0.0 111.235 -175.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -88.23 154.7 20.22 Favored 'General case' 0 C--N 1.353 0.759 0 C-N-CA 123.703 0.801 . . . . 0.0 110.048 177.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.476 HG21 ' HB2' ' A' ' 96' ' ' SER . 13.9 mm -84.14 99.16 6.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.694 HD11 HD12 ' A' ' 86' ' ' LEU . 10.0 pt -83.6 -8.38 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 122.801 0.44 . . . . 0.0 111.82 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.76 103.85 0.19 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-O 119.802 -0.443 . . . . 0.0 112.293 176.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.476 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.6 t -100.57 119.39 38.46 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.805 0.842 . . . . 0.0 109.229 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.3 t -73.77 167.33 21.63 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.94 0.496 . . . . 0.0 110.8 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.453 ' NE2' ' HB ' ' A' ' 42' ' ' THR . 77.5 mt-30 -85.38 166.63 16.26 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.382 0.673 . . . . 0.0 110.494 177.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 72.1 mtm -74.35 118.63 17.54 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.579 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -94.41 144.3 25.67 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.124 0.97 . . . . 0.0 109.005 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.536 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -62.25 -58.02 9.28 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.418 0.687 . . . . 0.0 110.707 -178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.7 p -110.73 169.15 8.95 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.022 0.929 . . . . 0.0 110.954 -177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.74 -30.01 65.15 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.97 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -64.41 -32.49 74.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.109 0.564 . . . . 0.0 110.971 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.4 t -79.05 -32.89 45.02 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.755 0.822 . . . . 0.0 110.426 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -69.22 -38.72 78.68 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.724 0.81 . . . . 0.0 111.515 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -75.61 -29.87 59.38 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 122.95 0.5 . . . . 0.0 111.281 178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 47.0 m -65.83 -34.31 77.86 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.43 -46.22 93.11 Favored Glycine 0 C--N 1.351 1.372 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.153 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 17.0 mm -55.09 -46.84 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.54 0.736 . . . . 0.0 109.839 176.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.22 93.16 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.9 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.7 t -71.63 -46.57 58.66 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.205 0.602 . . . . 0.0 110.361 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 81.0 t -64.86 -30.9 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.943 0.897 . . . . 0.0 111.124 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -66.92 -51.5 54.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.362 0.665 . . . . 0.0 110.405 173.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.84 -20.94 55.74 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.802 0.841 . . . . 0.0 112.431 -172.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -112.17 -8.16 14.01 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.824 0.849 . . . . 0.0 111.051 -178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -73.74 -28.13 65.72 Favored Glycine 0 C--N 1.344 1.011 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 172.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 12.6 t -74.25 -9.36 58.53 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.0 0.92 . . . . 0.0 111.83 175.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 32.4 t -72.92 147.01 45.71 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.206 0.602 . . . . 0.0 109.437 176.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -131.46 25.21 4.8 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.589 0.756 . . . . 0.0 110.657 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.4 t -95.88 110.84 22.96 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 172.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 39.3 t -119.27 117.32 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.587 0.755 . . . . 0.0 110.209 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -78.27 135.74 37.61 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.124 . . . . 0.0 109.182 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -89.02 107.99 19.34 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -114.76 15.39 17.52 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.657 0.783 . . . . 0.0 110.305 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.6 p -64.15 89.05 0.06 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.431 0.692 . . . . 0.0 111.745 -175.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . 0.423 ' N ' ' HG2' ' A' ' 25' ' ' LYS . . . 66.27 44.37 90.93 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.816 175.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 17.8 t -68.8 90.81 0.43 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.683 0.793 . . . . 0.0 109.744 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.2 t30 . . . . . 0 C--O 1.251 1.145 0 C-N-CA 124.216 1.006 . . . . 0.0 109.585 -172.0 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m -89.14 152.55 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.511 0.725 . . . . 0.0 110.11 174.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 pp -83.14 161.87 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 122.763 0.425 . . . . 0.0 110.463 174.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.5 mmt -128.61 130.63 47.58 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.33 74.89 9.27 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.268 0.627 . . . . 0.0 110.602 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.6 157.04 7.49 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.391 -0.822 . . . . 0.0 113.751 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -165.39 155.52 13.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.296 1.038 . . . . 0.0 109.842 -178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' HD13 ' A' ' 35' ' ' LEU . 59.6 m-85 -97.4 148.41 23.21 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.575 0.75 . . . . 0.0 109.937 169.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 46.4 mt-10 -129.75 117.61 20.54 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.852 0.861 . . . . 0.0 108.703 170.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 31' ' ' PHE . 28.7 tp -81.63 102.45 10.68 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 175.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.1 m -106.49 162.84 13.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.217 1.007 . . . . 0.0 108.816 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -121.44 165.68 15.23 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 61.0 p -96.75 173.79 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 123.932 0.893 . . . . 0.0 110.034 176.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.1 t -67.46 -21.72 65.53 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.351 0.596 . . . . 0.0 110.244 171.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.78 -13.14 60.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.321 1.048 . . . . 0.0 111.657 174.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 86.0 -7.04 0.8 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 126.348 1.859 . . . . 0.0 112.4 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.642 ' HB3' ' HB3' ' A' ' 48' ' ' LEU . 8.7 mp0 -65.63 132.96 50.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.196 0.598 . . . . 0.0 110.675 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.521 ' HB3' HD11 ' A' ' 23' ' ' LEU . 83.7 m-85 -91.31 148.54 22.26 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.358 1.063 . . . . 0.0 110.58 -171.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -152.59 129.9 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.433 0.693 . . . . 0.0 109.306 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -91.21 126.93 36.45 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 173.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.38 130.27 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -99.25 123.01 43.2 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 173.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -118.68 149.51 41.29 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.259 1.024 . . . . 0.0 108.901 177.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.84 -179.15 6.4 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.441 0.696 . . . . 0.0 110.242 172.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.44 -20.27 65.41 Favored Glycine 0 N--CA 1.477 1.421 0 CA-C-O 120.997 0.221 . . . . 0.0 112.99 177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -78.43 -10.3 59.64 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.293 1.037 . . . . 0.0 111.186 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.81 -0.66 89.15 Favored Glycine 0 C--N 1.351 1.391 0 C-N-CA 123.035 0.35 . . . . 0.0 113.067 -175.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -72.38 121.76 20.06 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.064 0.945 . . . . 0.0 110.132 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.5 m -71.39 120.2 16.63 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.415 HD11 ' HG ' ' A' ' 35' ' ' LEU . 26.7 pt -109.98 -8.35 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.699 1.2 . . . . 0.0 111.159 -177.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.475 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 16.9 tp -164.31 151.25 11.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.153 0.581 . . . . 0.0 110.487 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 46.7 m -146.1 126.34 13.89 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.462 ' HA ' ' HA2' ' A' ' 95' ' ' GLY . 87.3 p -67.01 155.13 39.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.35 0.66 . . . . 0.0 111.031 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.86 138.39 58.14 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 172.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.642 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 10.4 mp -64.07 111.97 2.77 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 121.199 0.523 . . . . 0.0 110.582 -173.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.3 m-85 -82.34 147.6 28.76 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.247 1.019 . . . . 0.0 110.657 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.3 m -69.76 -37.24 76.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.562 0.745 . . . . 0.0 110.886 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -112.69 155.33 24.69 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.564 0.746 . . . . 0.0 110.848 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -62.91 -43.18 99.48 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.946 0.898 . . . . 0.0 109.14 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 64.5 p -61.02 -40.78 94.85 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.086 0.866 . . . . 0.0 110.917 -177.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 20.0 m -63.13 -39.97 96.23 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.613 0.765 . . . . 0.0 110.931 178.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.2 84.32 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.527 0.731 . . . . 0.0 110.992 176.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -68.66 -32.11 71.71 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.667 0.787 . . . . 0.0 111.082 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -77.82 -22.94 49.25 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.086 0.554 . . . . 0.0 110.949 171.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.18 -41.57 94.83 Favored Glycine 0 C--N 1.351 1.406 0 O-C-N 123.819 0.699 . . . . 0.0 113.778 178.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.5 tt -64.16 -37.79 80.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 117.02 0.41 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.86 -30.96 71.27 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.289 0.635 . . . . 0.0 110.952 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 m -73.14 -49.96 25.32 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.624 177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.401 HG22 ' HA ' ' A' ' 59' ' ' ILE . 26.0 m -65.46 -38.8 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.538 -173.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -65.56 -32.99 74.88 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.074 0.464 . . . . 0.0 110.923 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.7 t -74.27 -24.53 59.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.594 0.758 . . . . 0.0 111.03 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -107.41 3.1 24.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.312 0.645 . . . . 0.0 111.469 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.507 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 75.7 m -63.76 -43.6 77.22 Favored Pre-proline 0 N--CA 1.487 1.393 0 CA-C-O 118.545 -0.741 . . . . 0.0 112.768 174.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -83.95 18.93 1.44 Allowed 'Trans proline' 0 C--N 1.38 2.222 0 CA-C-N 121.657 1.628 . . . . 0.0 113.02 175.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -118.79 96.63 5.34 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.09 0.956 . . . . 0.0 109.895 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -26.7 68.4 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.917 0.487 . . . . 0.0 110.199 173.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -45.88 -40.8 10.49 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.815 1.646 . . . . 0.0 112.513 171.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -90.06 -23.82 21.33 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.338 0.655 . . . . 0.0 111.253 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -70.41 118.41 13.19 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 120.649 0.262 . . . . 0.0 110.333 175.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -96.04 98.64 10.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -66.45 103.61 1.08 Allowed 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -124.87 139.77 53.53 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.642 0.777 . . . . 0.0 109.731 -164.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -97.28 127.93 43.68 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.228 0.611 . . . . 0.0 110.083 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.28 150.67 40.1 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.887 0.875 . . . . 0.0 110.71 171.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 t -71.4 -8.17 52.08 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-O 121.313 0.578 . . . . 0.0 110.016 171.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.587 HD22 ' HG2' ' A' ' 99' ' ' MET . 62.0 m-20 -74.57 -3.74 32.84 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.557 1.143 . . . . 0.0 111.906 169.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.94 13.51 82.08 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 123.042 0.353 . . . . 0.0 112.625 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -110.64 178.42 4.37 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.208 1.003 . . . . 0.0 110.202 -177.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -126.3 127.77 46.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.69 0.396 . . . . 0.0 110.982 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.604 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 20.3 p90 -129.65 176.7 7.79 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.835 1.254 . . . . 0.0 108.688 174.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -133.54 150.35 51.67 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.768 0.318 . . . . 0.0 110.174 174.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.516 ' ND2' ' HE3' ' A' ' 87' ' ' LYS . 3.4 p-10 -133.41 124.08 26.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.52 129.23 34.88 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 123.816 0.847 . . . . 0.0 109.614 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.516 ' HE3' ' ND2' ' A' ' 85' ' ' ASN . 34.2 mmtp -99.82 162.01 13.26 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.298 1.039 . . . . 0.0 111.355 -178.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.43 179.52 4.25 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 114.183 -1.372 . . . . 0.0 109.413 173.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.36 -15.63 63.35 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.06 0.544 . . . . 0.0 111.128 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -96.9 16.49 19.2 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.661 0.784 . . . . 0.0 111.968 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 80.6 m80 64.24 9.5 4.86 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 124.433 1.093 . . . . 0.0 112.723 -179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -88.04 146.47 25.45 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.248 0.619 . . . . 0.0 110.508 -176.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.4 mt -82.88 100.57 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.9 pt -86.98 -13.1 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 122.965 0.506 . . . . 0.0 110.829 177.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.462 ' HA2' ' HA ' ' A' ' 46' ' ' SER . . . -153.11 149.83 21.47 Favored Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 176.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.8 p -158.32 128.54 6.07 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.479 0.711 . . . . 0.0 109.502 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.7 t -107.37 166.97 10.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.318 0.647 . . . . 0.0 110.688 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -75.03 161.24 29.62 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.508 0.723 . . . . 0.0 110.724 177.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.604 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -74.7 118.67 17.93 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.381 0.61 . . . . 0.0 110.005 -178.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -83.51 148.44 27.21 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.316 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.33 71.79 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.956 0.902 . . . . 0.0 112.117 -177.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.3 p -128.94 162.68 27.0 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.483 0.713 . . . . 0.0 110.188 175.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.455 ' O ' ' HG2' ' A' ' 107' ' ' GLU . . . -65.5 -36.09 82.81 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.139 172.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.0 -37.91 89.06 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.489 0.715 . . . . 0.0 111.503 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.0 t -67.92 -30.58 69.94 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.57 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -70.59 -38.21 74.0 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.865 0.466 . . . . 0.0 110.704 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 7.1 mm-40 -68.09 -28.9 67.74 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.127 0.571 . . . . 0.0 111.011 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 17.2 m -61.72 -45.95 91.75 Favored 'General case' 0 C--N 1.349 0.577 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.07 -34.84 91.01 Favored Glycine 0 C--N 1.349 1.285 0 CA-C-N 115.056 -0.974 . . . . 0.0 113.526 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 28.6 mm -60.05 -52.37 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.1 66.44 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.473 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.1 t -70.72 -50.07 40.2 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.248 0.619 . . . . 0.0 110.003 -178.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.55 -30.67 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 C-N-CA 123.504 0.721 . . . . 0.0 110.871 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 83.9 tttt -64.2 -35.02 79.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.432 0.693 . . . . 0.0 111.45 177.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -93.49 -36.17 12.58 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.663 0.785 . . . . 0.0 112.49 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -103.76 -8.56 19.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.096 0.958 . . . . 0.0 111.785 -168.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.61 -22.79 73.61 Favored Glycine 0 N--CA 1.472 1.041 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.131 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -84.06 -12.12 55.63 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.662 0.785 . . . . 0.0 111.354 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.8 m -69.42 101.59 1.59 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 109.888 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -82.86 18.95 1.45 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.272 0.629 . . . . 0.0 111.915 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 22.6 m -75.32 93.95 2.96 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.298 1.039 . . . . 0.0 109.353 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.62 139.32 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.662 0.785 . . . . 0.0 110.903 -172.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -118.91 115.36 24.21 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.351 1.06 . . . . 0.0 109.099 175.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.38 97.35 7.68 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 121.421 0.629 . . . . 0.0 111.142 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -77.59 -16.01 58.87 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.179 0.992 . . . . 0.0 111.312 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 35.9 p -61.58 114.88 3.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.553 1.141 . . . . 0.0 112.459 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 82.66 56.73 2.72 Favored Glycine 0 C--N 1.346 1.123 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.707 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.4 t -133.64 164.28 27.55 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.643 0.777 . . . . 0.0 109.753 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 N--CA 1.487 1.407 0 C-N-CA 123.517 0.727 . . . . 0.0 112.045 -174.675 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.196 0 CA-C-O 119.928 -0.373 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 36.0 m -89.95 159.61 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.028 0.931 . . . . 0.0 109.952 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.3 pt -72.06 149.16 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 120.885 0.374 . . . . 0.0 110.117 174.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.405 ' HB3' ' HA3' ' A' ' 38' ' ' GLY . 21.0 mmt -103.76 104.17 14.15 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.093 0.557 . . . . 0.0 109.589 -178.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.58 131.45 40.31 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 174.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.14 173.78 50.47 Favored Glycine 0 C--N 1.333 0.415 0 O-C-N 123.375 0.422 . . . . 0.0 113.526 -179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 38.3 p90 -119.51 160.3 22.66 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.916 0.887 . . . . 0.0 110.597 -173.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -86.95 153.31 21.68 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.807 -1.088 . . . . 0.0 108.976 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.438 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 86.6 mt-10 -132.86 121.21 22.57 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 167.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.2 tp -78.28 98.16 5.81 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.7 m -99.33 163.04 12.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 113.453 -1.703 . . . . 0.0 108.84 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HG2' ' HA ' ' A' ' 126' ' ' THR . 17.2 ptpt -133.83 134.12 42.42 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 168.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.9 m -76.62 175.47 9.27 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.319 0.581 . . . . 0.0 110.896 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 t -67.5 -12.58 60.65 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.619 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -83.37 3.59 31.08 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.658 1.183 . . . . 0.0 112.219 175.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 m120 65.67 15.32 9.99 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.167 0.987 . . . . 0.0 111.923 -175.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HB2' HD12 ' A' ' 48' ' ' LEU . 15.0 mm100 -96.29 137.76 34.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.864 0.865 . . . . 0.0 109.914 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -90.55 144.22 25.99 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.034 0.534 . . . . 0.0 110.73 -175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -156.97 147.04 20.96 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 109.064 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -94.28 127.5 40.18 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.3 m -107.47 132.8 54.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.684 HD22 ' HB3' ' A' ' 116' ' ' ASN . 11.5 mt -99.24 112.24 24.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.395 0.678 . . . . 0.0 109.257 177.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -102.75 125.94 49.68 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.98 178.05 1.2 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 123.758 0.661 . . . . 0.0 111.097 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.405 ' HA3' ' HB3' ' A' ' 17' ' ' MET . . . -61.91 -12.75 37.34 Favored Glycine 0 CA--C 1.541 1.685 0 N-CA-C 114.079 0.392 . . . . 0.0 114.079 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -85.2 -6.22 59.29 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.411 1.085 . . . . 0.0 112.017 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 14.32 81.9 Favored Glycine 0 N--CA 1.473 1.121 0 C-N-CA 122.727 0.204 . . . . 0.0 112.982 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -102.75 121.5 42.59 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.328 1.051 . . . . 0.0 109.764 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.1 m -66.21 120.97 14.17 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.074 0.55 . . . . 0.0 110.459 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 33.2 pt -99.93 -35.41 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 C-N-CA 124.616 1.166 . . . . 0.0 110.366 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 20.4 tp -137.38 148.47 46.25 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.701 0.801 . . . . 0.0 109.926 -169.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 88.1 m -145.15 116.81 8.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.32 0.648 . . . . 0.0 109.506 175.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.5 t -65.44 157.72 28.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.087 0.955 . . . . 0.0 110.801 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.84 164.83 18.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.126 0.571 . . . . 0.0 111.153 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.5 mm? -70.65 127.92 34.33 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.167 -178.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.452 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 93.9 m-85 -107.7 142.68 37.32 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.119 0.968 . . . . 0.0 109.706 177.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.3 -22.5 63.79 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.368 0.667 . . . . 0.0 111.749 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.7 t -148.42 159.5 43.97 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.237 0.615 . . . . 0.0 111.483 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -27.96 68.3 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.786 0.835 . . . . 0.0 111.177 176.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.9 t -71.27 -32.51 68.79 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.912 0.485 . . . . 0.0 110.731 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.452 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 16.4 m -69.04 -40.87 78.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.492 0.717 . . . . 0.0 109.61 173.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.98 -31.67 72.39 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.355 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.83 -40.33 95.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.546 0.739 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -71.3 -34.37 70.55 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.525 175.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.23 -41.45 98.29 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.637 -0.711 . . . . 0.0 113.14 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.464 ' HA ' HG22 ' A' ' 62' ' ' VAL . 12.6 tt -74.68 -37.73 43.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.741 0.27 . . . . 0.0 110.742 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.75 -33.62 70.47 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.059 0.544 . . . . 0.0 110.267 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 m -71.53 -55.71 7.29 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.708 177.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 59' ' ' ILE . 33.7 m -59.61 -31.2 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-N 118.27 0.486 . . . . 0.0 111.758 -176.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -62.5 -47.85 82.12 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.54 1.136 . . . . 0.0 110.546 176.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.3 m -72.26 -26.1 61.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.025 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.496 ' ND2' ' HG2' ' A' ' 71' ' ' ARG . 4.3 m-20 -96.39 1.59 51.89 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.326 1.051 . . . . 0.0 111.794 -174.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.548 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 23.5 m -59.46 -50.27 88.08 Favored Pre-proline 0 CA--C 1.565 1.525 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.777 175.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -83.03 -5.78 11.29 Favored 'Trans proline' 0 C--N 1.394 2.934 0 C-N-CA 121.824 1.682 . . . . 0.0 113.232 175.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -83.32 78.35 9.64 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.62 -30.22 71.36 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.925 0.89 . . . . 0.0 112.055 -175.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.18 -24.45 59.37 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.626 0.77 . . . . 0.0 111.195 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.496 ' HG2' ' ND2' ' A' ' 65' ' ' ASN . 3.4 tpm_? -75.79 -23.25 55.87 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.196 0.599 . . . . 0.0 110.661 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -70.55 120.56 16.36 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 167.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -101.36 108.3 19.88 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.482 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 135.58 33.49 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.665 0.386 . . . . 0.0 110.093 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -155.59 161.43 40.84 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 109.747 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.9 m -92.56 141.55 28.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.05 0.54 . . . . 0.0 109.814 176.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.69 158.0 28.45 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.712 0.805 . . . . 0.0 109.943 170.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.9 t -64.06 -23.79 67.46 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.307 0.643 . . . . 0.0 110.714 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -66.9 -18.44 65.38 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.876 0.871 . . . . 0.0 111.693 174.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.88 -7.9 42.12 Favored Glycine 0 C--N 1.349 1.271 0 C-N-CA 122.961 0.315 . . . . 0.0 113.591 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.529 ' HG3' ' HA ' ' A' ' 101' ' ' ALA . 0.0 OUTLIER -99.31 146.18 26.52 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.18 0.592 . . . . 0.0 110.734 -176.367 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -90.43 139.19 30.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.155 0.982 . . . . 0.0 110.415 -172.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -148.64 174.86 11.71 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.674 0.79 . . . . 0.0 109.268 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -131.14 138.74 49.6 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.585 0.707 . . . . 0.0 111.458 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.547 HD22 HD13 ' A' ' 93' ' ' ILE . 11.5 m-20 -114.9 105.56 13.14 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.892 1.277 . . . . 0.0 108.904 172.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.7 OUTLIER -78.7 111.6 14.96 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 173.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -120.73 146.18 46.74 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 176.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.415 ' HB2' HD13 ' A' ' 94' ' ' ILE . . . -86.44 -173.88 4.74 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.443 0.697 . . . . 0.0 111.13 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.35 -28.1 67.91 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -171.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -95.9 24.42 5.49 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.096 0.558 . . . . 0.0 111.571 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.0 t60 72.3 -3.79 2.19 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.718 1.207 . . . . 0.0 112.231 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -70.61 112.63 7.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.381 0.672 . . . . 0.0 109.93 -176.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.547 HD13 HD22 ' A' ' 85' ' ' ASN . 57.0 mt -67.39 98.35 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 122.032 0.92 . . . . 0.0 109.071 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 21.3 pt -82.67 -6.68 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.144 -178.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -164.03 117.24 0.75 Allowed Glycine 0 C--N 1.345 1.034 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.5 t -116.12 114.86 25.07 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.903 0.881 . . . . 0.0 108.944 175.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.9 p -81.79 167.76 18.72 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.842 0.457 . . . . 0.0 111.283 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -77.23 164.31 25.72 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.226 177.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.8 ptp -73.58 123.5 24.1 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -102.31 122.08 43.54 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.77 0.828 . . . . 0.0 109.773 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.529 ' HA ' ' HG3' ' A' ' 81' ' ' LYS . . . -62.79 -40.72 98.19 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.816 0.846 . . . . 0.0 110.845 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.462 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 39.1 p -104.87 131.3 52.53 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.856 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.42 -19.21 65.35 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.306 1.042 . . . . 0.0 111.828 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.462 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 10.8 pt20 -62.93 -37.43 87.0 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.024 0.53 . . . . 0.0 110.737 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 13.9 t -71.31 -28.53 64.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.383 0.673 . . . . 0.0 110.515 -177.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -67.36 -51.2 55.1 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.105 0.962 . . . . 0.0 109.87 177.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.96 -29.09 60.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.095 0.558 . . . . 0.0 111.948 -176.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 98.0 m -67.57 -33.51 75.17 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.2 -30.12 76.56 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.171 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 39.3 mm -64.96 -49.39 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-O 121.368 0.604 . . . . 0.0 109.886 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.01 -31.91 73.08 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.198 178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.2 t -71.13 -48.65 50.89 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.16 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 86.9 t -66.19 -27.12 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.448 0.699 . . . . 0.0 110.724 177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 38.8 ttpt -66.59 -46.75 74.92 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 172.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.58 -33.66 69.24 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.906 0.883 . . . . 0.0 111.92 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.684 ' HB3' HD22 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -84.39 -30.99 24.94 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 0.0 110.01 -177.158 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.54 -41.17 58.27 Favored Glycine 0 C--N 1.341 0.847 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.5 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 56.1 p -80.47 -4.71 54.84 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.446 0.698 . . . . 0.0 111.713 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.8 t -75.77 -34.33 60.24 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.992 0.517 . . . . 0.0 109.835 173.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 67.75 -7.64 0.58 Allowed 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 125.37 1.468 . . . . 0.0 114.261 167.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 t -80.31 123.98 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.229 0.612 . . . . 0.0 110.768 -170.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 57.6 t -105.52 133.95 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 123.35 0.66 . . . . 0.0 111.303 -174.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.438 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 43.1 tptt -110.45 141.76 43.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.11 1.364 . . . . 0.0 108.411 173.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -84.24 112.4 20.25 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 174.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -110.7 11.59 22.67 Favored 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.891 0.853 . . . . 0.0 109.687 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.455 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 21.7 p -70.51 156.75 38.97 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.255 1.022 . . . . 0.0 110.82 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 102.59 -42.18 1.96 Allowed Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -172.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 39.3 t -70.79 104.33 2.86 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.653 0.781 . . . . 0.0 109.097 173.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 123.797 0.839 . . . . 0.0 109.918 -176.772 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.907 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.5 m -85.04 155.86 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.362 0.665 . . . . 0.0 110.072 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.8 pt -74.3 156.15 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-O 121.013 0.435 . . . . 0.0 110.98 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.8 ptp -132.31 -179.66 5.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.141 0.976 . . . . 0.0 108.843 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -121.52 118.88 30.41 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 122.997 0.519 . . . . 0.0 110.447 -178.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . 88.8 143.05 9.04 Favored Glycine 0 C--N 1.348 1.229 0 O-C-N 123.499 0.5 . . . . 0.0 114.011 172.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -152.2 169.87 21.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.844 0.858 . . . . 0.0 109.958 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -109.98 127.15 54.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.347 1.059 . . . . 0.0 109.568 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -91.97 106.87 18.8 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 167.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 64.6 tp -85.52 98.5 10.66 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 176.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -113.37 177.92 4.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.937 0.895 . . . . 0.0 109.735 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -141.75 156.0 45.61 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.626 0.77 . . . . 0.0 109.935 175.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.6 m -89.86 178.69 6.17 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.126 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -66.65 -22.85 66.1 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.616 0.766 . . . . 0.0 110.801 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -91.11 15.36 11.86 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.415 0.686 . . . . 0.0 111.285 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 67.3 14.96 9.87 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.243 1.417 . . . . 0.0 112.75 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 16.0 mm100 -70.32 124.86 25.2 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.67 0.788 . . . . 0.0 110.997 -176.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.84 118.68 24.64 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.809 0.844 . . . . 0.0 108.942 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -142.49 118.99 10.95 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.92 0.888 . . . . 0.0 109.093 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -94.04 132.03 38.95 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 171.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.603 HG12 HG23 ' A' ' 45' ' ' THR . 23.2 m -107.45 133.97 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 171.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.9 tp -90.0 120.79 31.51 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -106.8 153.95 21.72 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.692 1.197 . . . . 0.0 109.653 173.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.19 177.66 8.88 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.775 168.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.34 -23.53 62.43 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.449 173.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -67.35 -18.89 65.33 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.766 1.227 . . . . 0.0 111.769 177.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 90.89 -7.82 80.66 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.796 -175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.05 136.23 36.53 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.286 0.634 . . . . 0.0 109.712 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.0 m -73.15 120.84 19.33 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.342 0.591 . . . . 0.0 109.779 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.534 HD11 ' HG ' ' A' ' 35' ' ' LEU . 22.0 pt -103.74 -16.52 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.606 1.162 . . . . 0.0 111.245 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.7 tp -157.8 141.7 15.79 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.603 HG23 HG12 ' A' ' 34' ' ' VAL . 53.3 m -133.16 113.45 12.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.242 0.617 . . . . 0.0 109.652 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -69.5 164.82 22.3 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.964 0.506 . . . . 0.0 110.799 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -75.92 166.01 24.14 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-O 121.399 0.619 . . . . 0.0 111.601 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.86 114.18 15.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.642 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -100.37 145.57 28.02 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.587 0.755 . . . . 0.0 109.17 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -90.15 -2.13 58.03 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 120.988 0.423 . . . . 0.0 111.099 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.439 ' HB3' HG22 ' A' ' 53' ' ' THR . 50.8 m -142.03 137.25 30.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.507 0.723 . . . . 0.0 110.549 -177.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -28.24 69.78 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.939 0.895 . . . . 0.0 111.64 178.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.439 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -63.22 -33.72 76.11 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.459 0.704 . . . . 0.0 111.156 178.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 m -76.56 -31.65 57.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.632 0.773 . . . . 0.0 110.466 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.19 -32.39 66.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.507 0.723 . . . . 0.0 110.752 173.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -67.4 -49.11 65.23 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.959 0.904 . . . . 0.0 110.37 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.63 -36.57 84.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.617 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.6 -48.51 85.84 Favored Glycine 0 C--N 1.345 1.049 0 O-C-N 124.124 0.89 . . . . 0.0 112.563 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.544 ' HA ' HG22 ' A' ' 62' ' ' VAL . 15.9 tt -74.64 -31.48 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 CA-C-N 116.608 0.204 . . . . 0.0 111.146 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.73 -38.68 82.36 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.972 0.509 . . . . 0.0 110.331 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.0 m -73.37 -47.71 40.0 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.13 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 59' ' ' ILE . 15.6 m -62.3 -35.29 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 118.654 0.661 . . . . 0.0 110.741 -177.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.713 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 12.2 ttp180 -66.25 -45.52 80.31 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.173 0.989 . . . . 0.0 110.357 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -67.92 -28.37 67.43 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.784 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.487 ' HB3' HD11 ' A' ' 86' ' ' LEU . 16.0 m120 -100.94 3.53 41.77 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.135 0.974 . . . . 0.0 111.777 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.0 m -63.11 -52.25 63.92 Favored Pre-proline 0 CA--C 1.56 1.346 0 CA-C-O 118.648 -0.691 . . . . 0.0 110.831 172.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.49 -19.46 42.82 Favored 'Trans proline' 0 C--N 1.4 3.238 0 C-N-CA 121.642 1.561 . . . . 0.0 111.65 175.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 64.6 mm-40 -81.73 77.21 8.6 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 121.944 0.878 . . . . 0.0 109.542 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -66.95 -21.17 65.99 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.405 -1.27 . . . . 0.0 112.166 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -74.43 -31.69 62.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.717 0.807 . . . . 0.0 110.603 174.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -76.51 -25.5 54.25 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.324 0.65 . . . . 0.0 111.74 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.654 ' HE1' HG23 ' A' ' 110' ' ' ILE . 8.3 p90 -107.53 132.96 52.68 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 121.133 0.492 . . . . 0.0 110.407 172.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -97.31 117.11 30.79 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.064 -174.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB2' ' HD2' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -71.77 104.08 3.31 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.214 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -119.71 151.73 38.29 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.23 1.012 . . . . 0.0 110.6 -169.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.0 m -106.17 124.64 49.91 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.351 0.66 . . . . 0.0 109.755 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.26 166.24 16.83 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.487 1.115 . . . . 0.0 112.046 175.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.9 p -64.87 -16.9 63.78 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.06 0.944 . . . . 0.0 112.112 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -90.36 9.71 27.86 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.056 0.943 . . . . 0.0 110.999 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.44 6.85 71.62 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 123.026 0.345 . . . . 0.0 113.758 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 101' ' ' ALA . 48.2 mmtm -88.98 152.26 21.81 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.069 0.948 . . . . 0.0 110.499 -177.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.43 ' HB3' ' HB2' ' A' ' 106' ' ' ARG . 89.4 m-85 -109.74 126.52 53.82 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.378 0.671 . . . . 0.0 111.017 -170.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.667 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 16.5 p90 -143.97 178.85 7.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.68 1.192 . . . . 0.0 108.538 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.504 ' HE2' HG21 ' A' ' 113' ' ' VAL . 19.6 p90 -146.26 135.08 22.38 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.6 p-10 -116.04 146.12 42.44 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.487 HD11 ' HB3' ' A' ' 65' ' ' ASN . 25.3 tp -119.08 120.35 36.91 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.667 0.787 . . . . 0.0 109.982 -173.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -91.89 149.96 21.29 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.487 1.115 . . . . 0.0 110.985 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -107.69 176.15 5.25 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 124.354 1.062 . . . . 0.0 109.554 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.55 -28.2 66.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.56 0.744 . . . . 0.0 111.632 175.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -81.41 5.88 16.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.552 0.741 . . . . 0.0 112.153 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.6 m80 66.24 13.12 9.01 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.685 1.194 . . . . 0.0 111.916 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.77 153.42 17.77 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 124.042 0.937 . . . . 0.0 109.874 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 31.5 mm -81.85 119.02 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 171.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.2 pt -98.17 -8.98 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.187 174.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -177.92 111.36 0.33 Allowed Glycine 0 C--N 1.347 1.159 0 O-C-N 123.452 0.47 . . . . 0.0 112.344 175.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.2 p -114.91 131.6 56.82 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.1 t -85.97 158.19 19.94 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 123.175 0.59 . . . . 0.0 110.261 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -78.41 149.08 33.39 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.667 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 25.0 ptt? -74.06 117.32 15.72 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.23 0.538 . . . . 0.0 110.662 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -89.45 160.08 16.96 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.602 1.161 . . . . 0.0 111.283 -176.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.448 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . . . -75.84 -52.44 10.36 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.063 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 67.9 p -85.37 142.77 29.06 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.467 -171.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.48 -25.77 64.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.949 0.9 . . . . 0.0 111.191 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -68.56 -36.36 78.66 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 122.98 0.512 . . . . 0.0 110.505 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.2 t -67.96 -23.2 65.02 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.858 0.863 . . . . 0.0 111.309 -177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.478 ' O ' HG12 ' A' ' 110' ' ' ILE . 55.7 ttp180 -61.28 -56.84 15.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.365 0.666 . . . . 0.0 109.547 172.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -72.94 -32.97 65.64 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.901 0.88 . . . . 0.0 111.753 -175.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 91.9 m -67.28 -36.09 80.85 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.562 0.745 . . . . 0.0 109.436 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.42 -35.84 63.15 Favored Glycine 0 C--N 1.347 1.187 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.04 176.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.654 HG23 ' HE1' ' A' ' 72' ' ' TYR . 45.4 mm -57.06 -46.9 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.4 0.68 . . . . 0.0 109.419 172.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.95 -37.06 78.62 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.232 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t -67.26 -51.92 47.1 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.059 -174.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.504 HG21 ' HE2' ' A' ' 84' ' ' PHE . 79.6 t -64.9 -31.98 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 123.24 0.616 . . . . 0.0 111.27 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -62.87 -39.38 94.25 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.502 0.721 . . . . 0.0 112.026 -179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -92.51 -43.82 8.96 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.313 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.473 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 59.6 m-20 -83.98 -18.94 35.5 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.997 0.919 . . . . 0.0 111.746 -171.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.8 -27.75 64.25 Favored Glycine 0 C--N 1.341 0.808 0 O-C-N 123.168 0.292 . . . . 0.0 112.886 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 48.1 p -75.17 -7.83 54.9 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 87.7 p -68.98 -44.22 73.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.379 0.672 . . . . 0.0 111.308 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.471 ' HB2' ' HD3' ' A' ' 63' ' ' ARG . 43.6 tt0 61.9 13.78 5.82 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.028 1.331 . . . . 0.0 111.947 -177.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 m -81.46 89.2 6.13 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.672 -0.643 . . . . 0.0 111.107 -169.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 10.4 m -85.48 112.3 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-O 121.601 0.715 . . . . 0.0 111.728 -176.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -83.03 102.78 11.99 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 164.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -72.04 95.31 1.59 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.464 1.126 . . . . 0.0 109.826 -177.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -90.7 6.31 44.55 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.604 176.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 p -60.31 89.83 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.592 1.157 . . . . 0.0 110.817 173.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.69 52.22 6.65 Favored Glycine 0 C--N 1.346 1.093 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.653 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.6 t -87.1 -173.76 4.58 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.123 0.569 . . . . 0.0 109.548 172.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 8.6 t30 . . . . . 0 C--O 1.257 1.467 0 C-N-CA 122.958 0.503 . . . . 0.0 109.777 173.536 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.4 m -64.75 124.54 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 123.75 0.82 . . . . 0.0 110.498 176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.7 pt -81.41 139.87 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 122.972 0.509 . . . . 0.0 110.956 -174.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 80.8 mtp -93.97 96.12 9.49 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -179.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.48 90.06 7.85 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.453 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.452 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . 118.61 136.47 5.43 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.309 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -159.75 164.67 33.64 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.913 0.885 . . . . 0.0 110.272 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -104.47 154.41 19.92 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.024 0.93 . . . . 0.0 109.643 172.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 47.8 mt-10 -136.39 117.89 14.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.084 0.954 . . . . 0.0 109.238 169.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.567 HD21 ' HB2' ' A' ' 52' ' ' LYS . 64.2 tp -81.0 107.1 13.52 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.361 -0.978 . . . . 0.0 108.361 175.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.9 p -126.85 136.66 52.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.502 0.721 . . . . 0.0 110.946 -170.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -94.66 137.71 33.42 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.696 0.798 . . . . 0.0 108.855 175.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -93.91 -176.51 4.05 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.766 0.826 . . . . 0.0 111.432 -177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -67.6 -16.33 64.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.029 0.532 . . . . 0.0 110.559 174.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -68.85 -12.78 61.91 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.161 0.984 . . . . 0.0 112.072 174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.409 HD22 ' N ' ' A' ' 29' ' ' ASN . 0.8 OUTLIER 69.87 13.26 8.0 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.603 1.161 . . . . 0.0 110.493 -171.498 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.541 ' HB2' HD12 ' A' ' 48' ' ' LEU . 14.7 mm-40 -108.22 150.62 27.03 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.111 0.964 . . . . 0.0 110.123 -176.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -100.88 128.92 46.71 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.027 0.931 . . . . 0.0 110.585 -169.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 44.0 ptt85 -143.79 139.63 29.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.617 0.767 . . . . 0.0 109.056 174.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -94.97 137.09 34.48 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.87 132.33 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 175.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 17.9 tp -97.97 114.94 27.19 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -103.69 153.16 20.97 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.597 1.159 . . . . 0.0 110.375 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.8 -175.36 4.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.318 1.047 . . . . 0.0 110.234 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.56 -29.77 72.76 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 113.96 0.344 . . . . 0.0 113.96 -178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -72.58 -21.32 61.16 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.026 0.93 . . . . 0.0 111.086 176.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.16 7.5 59.5 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.204 -173.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -81.39 121.84 26.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.627 0.771 . . . . 0.0 109.748 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 m -70.08 121.64 17.86 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 122.914 0.485 . . . . 0.0 109.905 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.8 pt -100.06 -23.43 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.892 1.277 . . . . 0.0 110.74 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 18.8 tp -145.55 139.64 26.88 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.59 0.756 . . . . 0.0 109.574 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 85.3 m -135.91 125.2 24.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.508 0.723 . . . . 0.0 109.158 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.5 t -78.85 170.31 16.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 122.554 0.342 . . . . 0.0 110.99 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -74.38 161.64 29.65 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.522 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' ' 30' ' ' GLN . 3.8 mm? -68.75 111.6 4.96 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.038 174.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' A' ' 94' ' ' ILE . 79.3 m-85 -98.1 151.08 20.75 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.869 0.867 . . . . 0.0 109.992 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -69.35 -22.47 63.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.357 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.3 t -142.54 153.2 43.36 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.382 0.673 . . . . 0.0 110.705 -176.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.567 ' HB2' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -69.27 -27.22 65.23 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.654 175.451 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.7 p -60.81 -40.28 92.15 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.824 0.703 . . . . 0.0 110.659 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -65.43 -33.83 76.88 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.241 1.016 . . . . 0.0 111.347 177.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.24 -29.18 60.16 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.218 0.607 . . . . 0.0 111.402 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -74.32 -33.51 63.2 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.624 0.77 . . . . 0.0 110.24 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.5 -34.22 75.51 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.477 169.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.78 -49.87 73.86 Favored Glycine 0 C--N 1.349 1.271 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.714 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.488 ' HA ' HG22 ' A' ' 62' ' ' VAL . 8.0 tt -69.07 -35.56 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 117.037 0.419 . . . . 0.0 110.903 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -36.29 74.66 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.211 0.529 . . . . 0.0 110.289 175.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.9 m -75.76 -44.43 41.63 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.593 177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 59' ' ' ILE . 12.9 m -62.95 -32.42 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-N 119.381 0.991 . . . . 0.0 110.299 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.806 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -68.03 -50.58 54.47 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.383 1.073 . . . . 0.0 109.084 177.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.2 t -63.75 -31.52 72.73 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.093 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -107.5 16.57 23.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.133 0.973 . . . . 0.0 111.898 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -60.13 -52.68 71.64 Favored Pre-proline 0 CA--C 1.566 1.573 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.041 169.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -77.31 -6.13 16.2 Favored 'Trans proline' 0 C--N 1.399 3.226 0 C-N-CA 121.91 1.74 . . . . 0.0 112.435 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -96.22 82.33 3.43 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.69 -24.24 67.54 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.881 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -59.66 -29.99 68.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.885 0.874 . . . . 0.0 111.41 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -24.04 53.78 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.197 0.599 . . . . 0.0 111.384 -175.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -80.41 105.54 11.74 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -96.8 108.9 21.65 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.14 0.576 . . . . 0.0 109.856 177.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -78.26 117.55 19.63 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.387 0.675 . . . . 0.0 109.888 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -119.73 142.29 48.66 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.98 0.912 . . . . 0.0 110.398 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 26.4 m -94.76 111.29 23.08 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.22 154.62 12.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.236 1.014 . . . . 0.0 112.057 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.1 t -63.0 -17.45 62.18 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.024 0.93 . . . . 0.0 111.164 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.38 3.99 11.92 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.709 1.203 . . . . 0.0 111.839 174.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 80.77 0.06 87.31 Favored Glycine 0 C--N 1.354 1.535 0 C-N-CA 123.276 0.465 . . . . 0.0 112.778 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -87.73 165.29 15.47 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.029 0.931 . . . . 0.0 111.266 -172.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -113.82 129.17 56.62 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.366 0.666 . . . . 0.0 110.103 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -143.63 176.51 9.16 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.5 p90 -141.87 138.07 31.86 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 122.745 0.418 . . . . 0.0 110.212 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -99.31 166.94 10.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 169.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.621 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -135.1 121.3 20.15 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 -176.255 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -95.53 173.61 7.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.268 0.627 . . . . 0.0 111.864 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -135.87 174.28 10.79 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.67 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.26 -28.4 69.32 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.021 0.928 . . . . 0.0 111.386 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -85.97 6.9 26.57 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.556 0.742 . . . . 0.0 111.139 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 69.75 7.21 6.11 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.533 1.133 . . . . 0.0 111.606 -178.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.85 143.1 30.13 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.429 0.692 . . . . 0.0 110.678 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 52.8 mt -80.5 109.93 15.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.621 HD11 HD22 ' A' ' 86' ' ' LEU . 23.8 pt -91.42 -1.61 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 124.059 0.944 . . . . 0.0 112.26 -177.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.42 147.76 9.41 Favored Glycine 0 C--O 1.221 -0.695 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.6 p -154.81 129.07 8.98 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.675 0.79 . . . . 0.0 109.198 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.4 t -81.89 161.65 23.06 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 175.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -83.78 -78.43 0.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.796 0.438 . . . . 0.0 110.5 -171.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -168.22 121.67 0.89 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.225 0.61 . . . . 0.0 109.806 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -104.02 127.63 51.58 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.598 0.759 . . . . 0.0 109.68 173.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.37 -57.12 7.18 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.223 0.609 . . . . 0.0 109.702 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.498 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 38.8 p -85.5 125.57 33.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.703 174.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.7 -16.1 63.97 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.595 0.758 . . . . 0.0 112.276 -176.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.498 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 12.7 pt20 -65.17 -31.22 72.29 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.438 0.695 . . . . 0.0 110.977 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 19.9 m -72.79 -23.38 60.79 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.649 0.78 . . . . 0.0 111.085 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 110' ' ' ILE . 6.3 tmm_? -71.85 -40.72 68.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.66 0.784 . . . . 0.0 108.97 173.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -62.53 -50.49 71.13 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.805 0.842 . . . . 0.0 110.596 176.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.8 m -65.49 -29.97 70.68 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.208 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.9 -44.79 95.54 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.402 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 106' ' ' ARG . 37.3 mm -56.43 -49.18 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.401 0.68 . . . . 0.0 109.791 176.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.43 -36.25 82.34 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.793 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -72.1 -42.21 66.39 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.693 0.797 . . . . 0.0 110.52 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 71.0 t -70.19 -32.8 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.605 0.762 . . . . 0.0 110.76 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -67.46 -43.14 81.81 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.114 0.565 . . . . 0.0 110.572 175.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.15 -45.37 66.93 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.929 0.892 . . . . 0.0 111.47 -177.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.468 ' HB3' HD11 ' A' ' 35' ' ' LEU . 22.4 m120 -93.88 -1.85 54.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.2 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.62 -29.62 65.37 Favored Glycine 0 C--N 1.343 0.922 0 N-CA-C 111.996 -0.441 . . . . 0.0 111.996 174.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.806 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 14.7 t -88.63 5.71 41.71 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.803 0.841 . . . . 0.0 111.664 177.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.4 m -82.59 109.28 16.64 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.109 0.564 . . . . 0.0 109.695 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -86.5 74.63 9.88 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 122.031 0.92 . . . . 0.0 108.781 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 92.0 m -147.12 94.72 2.45 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.094 175.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.4 m -105.28 140.32 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.514 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 28.9 mtmm -107.76 117.63 34.62 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 170.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.83 94.59 1.06 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 175.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.42 -18.8 40.6 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.678 178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 40.2 p -63.09 93.29 0.06 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.335 1.054 . . . . 0.0 110.827 174.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.5 -36.82 3.71 Favored Glycine 0 C--N 1.343 0.968 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.823 -175.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 46.8 m -74.9 109.2 8.16 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.354 0.662 . . . . 0.0 110.432 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 12.3 m120 . . . . . 0 C--O 1.248 1.006 0 C-N-CA 123.486 0.714 . . . . 0.0 109.319 178.398 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.477 0 N-CA-C 112.293 -0.323 . . . . 0.0 112.293 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.3 m -109.46 152.43 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.842 0.857 . . . . 0.0 109.568 174.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 16.2 pt -95.84 88.26 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 122.098 0.952 . . . . 0.0 110.822 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.93 107.79 18.87 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.959 173.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.31 149.09 30.44 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.311 0.644 . . . . 0.0 110.776 -177.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.99 145.79 23.65 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.761 0.663 . . . . 0.0 111.99 175.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -130.94 151.32 51.48 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.526 0.73 . . . . 0.0 110.742 -175.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -90.26 155.02 19.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.752 -1.113 . . . . 0.0 108.543 168.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.592 ' HG2' ' HB3' ' A' ' 123' ' ' LYS . 41.3 mt-10 -132.46 124.5 28.7 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 31' ' ' PHE . 37.4 tp -79.7 99.5 7.44 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 175.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.0 p -106.57 156.85 18.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.28 1.432 . . . . 0.0 109.139 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.519 ' HB3' HG22 ' A' ' 126' ' ' THR . 21.6 ptmt -118.31 160.81 20.98 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.511 0.725 . . . . 0.0 109.869 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.3 t -120.39 177.81 4.89 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.457 0.703 . . . . 0.0 109.457 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -71.68 -8.52 54.65 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.142 0.577 . . . . 0.0 111.1 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.73 -4.2 33.06 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.201 1.0 . . . . 0.0 111.589 170.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 40.2 t-20 77.69 -12.94 1.01 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 125.614 1.565 . . . . 0.0 110.724 -178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -83.5 156.62 22.75 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.218 1.007 . . . . 0.0 112.111 -170.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.517 ' HB3' HD11 ' A' ' 23' ' ' LEU . 27.0 m-85 -97.7 151.55 20.02 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.172 -175.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -156.95 155.88 32.08 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.627 0.771 . . . . 0.0 109.442 176.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -102.3 131.53 48.82 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.017 0.527 . . . . 0.0 109.767 173.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -105.56 130.55 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.37 108.75 21.32 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -177.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -97.87 130.69 44.76 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 170.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -66.84 178.06 1.47 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.182 0.593 . . . . 0.0 110.806 172.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -61.58 -18.14 55.41 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-O 121.025 0.236 . . . . 0.0 113.261 174.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -74.21 -14.38 60.93 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 111.578 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.35 12.75 80.08 Favored Glycine 0 C--N 1.353 1.48 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.649 -172.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -98.38 124.31 42.98 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.529 0.732 . . . . 0.0 110.568 -175.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.6 m -70.48 121.51 17.91 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.1 pt -109.44 -34.75 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.038 0.935 . . . . 0.0 110.499 -178.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 22.7 tp -137.02 151.2 48.69 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -170.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 89.4 m -145.98 112.99 6.1 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.414 0.686 . . . . 0.0 110.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.4 m -58.39 156.18 10.65 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.983 0.913 . . . . 0.0 111.178 173.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.457 ' CG ' ' HB ' ' A' ' 93' ' ' ILE . 23.1 mm-40 -66.91 169.22 8.5 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.266 0.555 . . . . 0.0 111.917 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.34 111.95 11.14 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.612 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.483 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 63.8 m-85 -104.7 132.92 50.37 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.58 1.552 . . . . 0.0 109.31 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.6 p -62.07 -34.73 76.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.145 0.978 . . . . 0.0 111.589 -175.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m -122.45 152.82 39.88 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.57 1.148 . . . . 0.0 109.563 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.37 -27.3 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.809 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.8 t -72.09 -28.23 63.16 Favored 'General case' 0 C--N 1.36 1.048 0 O-C-N 123.56 0.538 . . . . 0.0 111.35 176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.483 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 19.3 m -71.38 -33.07 69.19 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.424 0.63 . . . . 0.0 109.79 174.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.21 -34.24 59.26 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.649 172.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -67.4 -42.69 82.9 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.423 1.089 . . . . 0.0 110.918 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -70.34 -27.38 64.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.085 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -59.68 -49.84 74.17 Favored Glycine 0 C--N 1.356 1.662 0 O-C-N 123.987 0.805 . . . . 0.0 112.695 177.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -70.23 -35.86 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 122.196 0.198 . . . . 0.0 111.066 177.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.1 -34.64 75.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.856 0.462 . . . . 0.0 110.746 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.9 m -76.0 -41.4 51.25 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.858 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.4 m -66.03 -30.82 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 CA-C-N 119.028 0.831 . . . . 0.0 110.355 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -64.07 -39.63 94.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.139 1.375 . . . . 0.0 111.091 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 t -89.25 -28.49 19.89 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.315 0.646 . . . . 0.0 111.314 -178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -97.22 3.39 51.44 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.181 0.592 . . . . 0.0 112.076 -174.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.643 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 11.7 p -69.43 -40.66 15.1 Favored Pre-proline 0 CA--C 1.568 1.66 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.854 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.48 -39.32 28.98 Favored 'Trans proline' 0 C--N 1.402 3.347 0 CA-C-N 121.484 1.566 . . . . 0.0 111.384 169.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -79.97 80.52 6.37 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.928 0.891 . . . . 0.0 110.235 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 12.4 pt-20 -68.13 -8.17 36.09 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.314 0.578 . . . . 0.0 111.868 174.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -49.64 -35.82 22.53 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.949 1.7 . . . . 0.0 112.217 165.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -85.28 -8.72 58.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.554 0.742 . . . . 0.0 112.41 -172.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -88.15 123.37 32.73 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.827 0.851 . . . . 0.0 109.179 177.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -95.7 96.79 9.23 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 170.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 pttt -85.58 121.53 28.4 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.556 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -145.23 142.5 29.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.457 0.703 . . . . 0.0 109.983 -173.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.6 m -99.82 130.05 45.98 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.145 0.578 . . . . 0.0 109.527 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.25 170.27 10.55 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.68 1.192 . . . . 0.0 111.845 178.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 m -64.55 -30.06 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.717 0.807 . . . . 0.0 111.464 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -72.77 -11.69 60.71 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.331 0.653 . . . . 0.0 112.146 175.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.17 18.4 53.56 Favored Glycine 0 C--N 1.344 0.996 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 -174.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.558 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.5 mmtp -84.88 121.82 28.29 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.309 0.644 . . . . 0.0 110.222 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 100' ' ' TYR . 73.8 m-85 -80.76 133.96 35.74 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.431 0.692 . . . . 0.0 109.76 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -152.22 173.66 14.71 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.458 0.647 . . . . 0.0 110.202 173.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -147.16 142.57 27.46 Favored 'General case' 0 C--O 1.246 0.912 0 C-N-CA 124.89 1.276 . . . . 0.0 108.213 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -117.18 110.6 18.35 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 174.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.677 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -77.9 128.03 33.3 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 178.759 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.592 ' HE2' HG12 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -113.55 145.45 41.21 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.788 0.835 . . . . 0.0 110.126 -171.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -89.79 170.64 10.25 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.958 0.903 . . . . 0.0 109.613 171.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.98 61.27 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.156 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.13 2.56 56.66 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.092 0.957 . . . . 0.0 111.512 175.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 67.8 17.58 9.74 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.797 1.239 . . . . 0.0 112.439 -175.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -79.34 126.65 31.08 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.592 HG12 ' HE2' ' A' ' 87' ' ' LYS . 39.8 mt -73.58 96.87 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.677 HD11 HD22 ' A' ' 86' ' ' LEU . 13.9 pt -79.95 -13.33 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.86 -175.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -158.73 129.91 2.38 Favored Glycine 0 C--O 1.218 -0.853 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 173.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.3 t -134.2 112.43 11.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.8 p -71.0 140.42 50.81 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -77.12 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 124.277 0.986 . . . . 0.0 110.11 -168.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.558 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 20.8 ptp -171.61 134.67 0.84 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.258 1.023 . . . . 0.0 108.732 168.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.466 ' HB2' ' HB2' ' A' ' 82' ' ' PHE . 24.0 m-85 -105.13 136.65 44.24 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.062 0.945 . . . . 0.0 110.258 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -92.33 -24.83 18.8 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.114 0.566 . . . . 0.0 110.618 174.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.468 ' HB ' ' HG2' ' A' ' 104' ' ' GLN . 74.0 p -115.07 132.53 56.57 Favored 'General case' 0 C--N 1.351 0.673 0 C-N-CA 123.66 0.784 . . . . 0.0 110.049 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -86.05 -20.28 29.03 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.578 0.751 . . . . 0.0 110.941 176.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.468 ' HG2' ' HB ' ' A' ' 102' ' ' THR . 14.0 pt20 -67.23 -33.77 76.07 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.861 0.864 . . . . 0.0 111.886 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.518 ' HB2' ' NH1' ' A' ' 106' ' ' ARG . 20.6 m -72.88 -18.46 61.42 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.111 0.564 . . . . 0.0 111.71 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.518 ' NH1' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER -59.99 -26.93 66.44 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.342 1.057 . . . . 0.0 112.473 178.416 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -58.5 -49.4 77.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.521 0.728 . . . . 0.0 110.472 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.5 m -76.23 -35.02 59.21 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.852 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.466 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -64.57 -51.94 47.55 Favored Glycine 0 C--N 1.349 1.277 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.874 -173.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 32.3 mm -59.17 -41.65 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 123.919 0.888 . . . . 0.0 111.224 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.11 90.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.107 0.563 . . . . 0.0 110.967 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.3 t -73.77 -30.26 62.67 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.43 0.692 . . . . 0.0 111.721 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 109' ' ' GLY . 79.5 t -74.22 -35.5 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 122.567 0.347 . . . . 0.0 110.102 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 66' ' ' SER . 68.7 mttm -70.65 -48.1 56.63 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.474 0.31 . . . . 0.0 111.089 174.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.49 -51.14 31.05 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.59 0.756 . . . . 0.0 111.967 -174.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -95.92 -7.47 36.57 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.182 0.593 . . . . 0.0 111.483 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.27 -21.08 71.02 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.084 0.24 . . . . 0.0 112.873 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.9 p -81.74 -1.45 47.13 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.372 0.669 . . . . 0.0 111.748 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 42.2 m -75.25 135.48 40.97 Favored 'General case' 0 C--N 1.348 0.541 0 C-N-CA 122.711 0.404 . . . . 0.0 110.941 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.02 -3.28 58.07 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.306 0.642 . . . . 0.0 110.47 169.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 35.3 m -65.86 101.93 0.71 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.215 1.006 . . . . 0.0 110.847 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 16.0 m -117.91 142.12 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.592 ' HB3' ' HG2' ' A' ' 22' ' ' GLU . 14.2 tmtt? -122.09 139.69 53.41 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -174.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.01 124.09 27.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.394 0.616 . . . . 0.0 111.659 -174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -132.63 -18.8 2.42 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.614 0.766 . . . . 0.0 109.944 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.519 HG22 ' HB3' ' A' ' 25' ' ' LYS . 8.4 p -62.66 101.09 0.22 Allowed 'General case' 0 C--N 1.36 1.062 0 C-N-CA 124.659 1.184 . . . . 0.0 111.004 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.32 -2.5 66.22 Favored Glycine 0 C--N 1.343 0.961 0 CA-C-N 115.582 -0.735 . . . . 0.0 113.21 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 m -86.59 73.23 10.11 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 15.7 m120 . . . . . 0 C--O 1.247 0.921 0 CA-C-N 114.843 -1.072 . . . . 0.0 108.511 -170.875 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.149 0 N-CA-C 112.28 -0.328 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.9 m -89.88 158.33 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 123.229 0.612 . . . . 0.0 109.467 174.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.4 pt -85.62 138.66 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.24 178.36 4.39 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.394 1.078 . . . . 0.0 109.362 176.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -132.08 122.9 26.16 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.513 ' HA3' ' HB3' ' A' ' 116' ' ' ASN . . . 96.48 128.22 5.71 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.574 0.546 . . . . 0.0 113.326 174.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 31.7 p90 -137.49 148.65 46.2 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 124.063 0.945 . . . . 0.0 110.058 -179.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -91.67 147.23 23.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.208 1.003 . . . . 0.0 108.859 170.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.549 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 42.9 mt-10 -133.75 116.37 15.67 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.471 0.709 . . . . 0.0 109.446 175.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' A' ' 31' ' ' PHE . 32.6 tp -83.25 99.51 10.02 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.381 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.9 p -108.84 147.59 31.88 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 124.329 1.052 . . . . 0.0 109.31 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' HG3' HG22 ' A' ' 126' ' ' THR . 9.9 mtmp? -95.78 143.69 26.8 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 173.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 78.5 p -86.73 -172.34 3.96 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.209 1.003 . . . . 0.0 111.159 -176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -68.27 -19.85 64.74 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 122.803 0.441 . . . . 0.0 110.437 171.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -84.11 -1.09 54.32 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.016 0.927 . . . . 0.0 111.948 174.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.5 t30 69.96 9.77 7.22 Favored 'General case' 0 CA--C 1.566 1.56 0 C-N-CA 124.73 1.212 . . . . 0.0 110.702 -175.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -88.3 154.4 20.44 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.589 0.756 . . . . 0.0 111.448 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.581 ' HB3' HD11 ' A' ' 23' ' ' LEU . 94.4 m-85 -89.79 125.15 35.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.247 1.019 . . . . 0.0 110.568 -171.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -137.56 130.33 30.08 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.922 1.289 . . . . 0.0 108.936 -177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -91.3 132.48 36.12 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.138 0.575 . . . . 0.0 109.638 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.49 HG12 HG23 ' A' ' 45' ' ' THR . 25.8 m -113.71 131.05 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 167.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 26.0 tp -101.7 110.26 22.21 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 177.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 61.2 mttp -100.4 143.17 30.9 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 123.849 0.86 . . . . 0.0 108.89 172.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.26 173.44 4.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.209 0.604 . . . . 0.0 110.144 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -63.15 -19.04 61.16 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.638 -0.255 . . . . 0.0 112.992 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -76.04 -4.08 39.37 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.295 1.038 . . . . 0.0 112.362 175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.42 4.25 89.03 Favored Glycine 0 C--N 1.348 1.232 0 CA-C-O 120.891 0.162 . . . . 0.0 112.842 -173.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -90.19 113.29 25.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.439 1.096 . . . . 0.0 109.24 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 22.1 m -61.84 129.52 41.34 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 122.837 0.455 . . . . 0.0 109.821 177.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.5 pt -115.8 -22.12 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 124.426 1.091 . . . . 0.0 110.581 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.4 tp -150.97 143.77 24.49 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.335 1.054 . . . . 0.0 108.319 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.49 HG23 HG12 ' A' ' 34' ' ' VAL . 96.3 m -139.55 112.15 7.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.6 0.76 . . . . 0.0 109.235 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.4 t -68.68 166.1 18.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.857 0.863 . . . . 0.0 110.542 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -89.27 -172.51 3.66 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -85.82 119.66 26.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.76 0.824 . . . . 0.0 110.984 -172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.441 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.0 m-85 -109.19 133.18 53.36 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.014 0.925 . . . . 0.0 108.95 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 70.3 p -61.04 -41.27 96.26 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.114 0.566 . . . . 0.0 110.972 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.7 m -119.73 148.48 43.36 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.321 1.048 . . . . 0.0 109.738 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' GLU . 16.4 ptpt -68.31 -27.03 65.93 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.433 0.293 . . . . 0.0 110.948 177.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 66.1 p -55.71 -37.63 68.66 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.737 0.815 . . . . 0.0 111.311 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.441 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 12.6 m -70.29 -38.92 75.11 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.907 0.883 . . . . 0.0 110.448 174.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.59 -28.53 67.84 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.471 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 52' ' ' LYS . 67.3 mm-40 -68.35 -38.89 81.9 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.239 0.616 . . . . 0.0 109.916 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 -31.67 70.72 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.294 173.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.415 ' O ' HG13 ' A' ' 62' ' ' VAL . . . -65.34 -49.15 62.69 Favored Glycine 0 C--N 1.344 0.99 0 O-C-N 123.975 0.797 . . . . 0.0 113.061 177.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.405 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.3 tt -72.52 -31.88 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 122.672 0.389 . . . . 0.0 110.977 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.9 85.4 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.673 0.389 . . . . 0.0 110.129 173.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 71.7 m -69.81 -47.15 63.88 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.836 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 58' ' ' GLY . 15.1 m -61.79 -34.22 61.44 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 CA-C-N 119.146 0.885 . . . . 0.0 111.618 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.29 -33.41 49.44 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 123.299 0.639 . . . . 0.0 109.727 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.7 t -75.18 -26.29 58.93 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.823 0.849 . . . . 0.0 111.097 175.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.18 0.63 43.76 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.266 1.026 . . . . 0.0 110.993 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.7 t -67.34 -40.0 24.1 Favored Pre-proline 0 CA--C 1.566 1.576 0 C-N-CA 123.007 0.523 . . . . 0.0 111.837 175.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -72.38 -23.85 20.06 Favored 'Trans proline' 0 C--N 1.39 2.723 0 C-N-CA 121.756 1.637 . . . . 0.0 113.229 166.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -79.94 90.87 5.36 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.914 0.485 . . . . 0.0 110.356 -177.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 72' ' ' TYR . 11.6 pt-20 -64.93 -24.17 67.44 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.015 0.926 . . . . 0.0 111.776 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.29 -14.47 62.61 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.978 0.911 . . . . 0.0 112.557 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.436 ' HA ' ' HE ' ' A' ' 71' ' ' ARG . 7.7 mmp_? -91.14 -24.04 20.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 122.769 0.428 . . . . 0.0 110.762 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.422 ' HD2' ' HA ' ' A' ' 69' ' ' GLU . 89.6 m-85 -75.46 95.78 3.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.161 0.584 . . . . 0.0 109.614 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -96.12 106.18 18.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.705 0.802 . . . . 0.0 109.857 -174.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.471 ' HB3' ' NE ' ' A' ' 106' ' ' ARG . 62.4 pttt -91.19 123.41 34.62 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.185 0.517 . . . . 0.0 111.223 -177.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.63 168.97 16.25 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.738 0.815 . . . . 0.0 109.494 175.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 7.4 m -100.4 112.65 25.02 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 168.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.23 163.05 1.23 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.464 1.106 . . . . 0.0 112.284 174.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 80.7 p -62.52 -20.26 64.44 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.373 0.669 . . . . 0.0 111.318 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -81.38 2.58 27.83 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.852 1.261 . . . . 0.0 111.882 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.33 19.3 79.64 Favored Glycine 0 C--N 1.353 1.49 0 C-N-CA 122.973 0.32 . . . . 0.0 113.455 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 99' ' ' MET . 73.3 mmtt -106.81 155.79 19.35 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.581 0.752 . . . . 0.0 110.125 -175.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -104.76 128.85 53.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.878 0.471 . . . . 0.0 109.834 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.556 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 2.0 p90 -148.84 174.34 12.32 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.607 ' HB3' ' HE ' ' A' ' 106' ' ' ARG . 43.8 p90 -130.19 136.12 48.9 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.026 0.53 . . . . 0.0 111.805 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -103.45 115.37 30.41 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 170.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 24.0 tp -80.1 113.62 18.41 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 173.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.437 ' HE2' HG12 ' A' ' 93' ' ' ILE . 35.1 mmtp -97.39 164.11 12.59 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.005 0.922 . . . . 0.0 111.226 -175.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.79 175.27 5.55 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.253 1.021 . . . . 0.0 110.861 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.93 -26.07 65.79 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.131 0.972 . . . . 0.0 111.101 175.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -88.11 12.03 14.67 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.878 0.871 . . . . 0.0 110.946 175.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 65.2 15.77 10.19 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.821 1.248 . . . . 0.0 112.335 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -82.45 151.14 26.68 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.447 0.699 . . . . 0.0 110.13 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.437 HG12 ' HE2' ' A' ' 87' ' ' LYS . 46.9 mt -87.69 97.57 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.1 pt -85.45 -10.58 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.737 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -165.66 117.12 0.73 Allowed Glycine 0 C--N 1.344 0.974 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.6 p -103.89 113.95 27.85 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 169.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 37.5 t -73.66 166.54 23.09 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.203 0.525 . . . . 0.0 110.926 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -74.35 147.72 41.94 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.318 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.556 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 24.3 ptt? -74.94 118.19 17.63 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -95.88 163.5 13.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.773 0.829 . . . . 0.0 110.666 -176.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.2 57.21 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.534 0.734 . . . . 0.0 111.253 -177.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.0 p -128.25 175.87 8.12 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.639 -178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -71.99 -20.52 61.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.025 0.93 . . . . 0.0 110.917 173.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -74.93 -42.76 57.1 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.832 0.853 . . . . 0.0 110.473 177.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.9 p -69.26 -22.11 63.85 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.822 0.449 . . . . 0.0 111.055 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.607 ' HE ' ' HB3' ' A' ' 84' ' ' PHE . 13.8 ttt180 -62.4 -41.81 98.96 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.626 0.37 . . . . 0.0 110.526 170.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -64.78 -36.1 83.24 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.256 0.622 . . . . 0.0 111.033 -177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.0 m -64.13 -36.85 85.39 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.881 171.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.88 -31.23 67.3 Favored Glycine 0 C--N 1.353 1.488 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.507 176.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.68 -49.57 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.93 -34.96 77.04 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.429 -1.259 . . . . 0.0 111.379 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t -69.1 -53.12 21.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.202 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.18 -31.56 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.628 0.771 . . . . 0.0 111.229 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -69.92 -50.5 41.5 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.362 0.665 . . . . 0.0 110.972 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.38 -19.25 36.42 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.394 0.678 . . . . 0.0 112.811 -173.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.513 ' HB3' ' HA3' ' A' ' 19' ' ' GLY . 91.0 m-20 -100.82 -30.77 11.51 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.647 0.779 . . . . 0.0 110.443 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.88 -17.26 77.53 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 116.089 -0.505 . . . . 0.0 113.62 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -71.18 -14.95 62.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.421 0.689 . . . . 0.0 111.65 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 98.2 p -65.68 -43.27 89.78 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 123.233 0.613 . . . . 0.0 110.223 176.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 59.25 19.78 7.89 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.705 1.202 . . . . 0.0 111.017 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 49.1 m -90.17 105.31 17.72 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.208 1.003 . . . . 0.0 109.457 -174.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.99 144.35 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 O-C-N 123.636 0.585 . . . . 0.0 110.895 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.549 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 25.8 mtpp -117.72 100.59 7.7 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 173.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -70.01 97.78 1.2 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.614 0.721 . . . . 0.0 109.49 -178.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -96.89 8.39 44.5 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.939 -176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.403 HG22 ' HG3' ' A' ' 25' ' ' LYS . 49.9 p -67.11 116.63 8.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.193 0.597 . . . . 0.0 109.505 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 112.58 -48.8 0.9 Allowed Glycine 0 C--N 1.346 1.092 0 N-CA-C 111.316 -0.713 . . . . 0.0 111.316 -175.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.4 m -88.8 74.95 8.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.332 0.653 . . . . 0.0 109.446 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.447 ' N ' HD22 ' A' ' 129' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.366 -172.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.437 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -83.47 153.77 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.13 0.572 . . . . 0.0 110.446 176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.6 pt -105.67 170.06 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.469 0.708 . . . . 0.0 110.168 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.6 mmt -74.53 94.99 2.7 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 173.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.62 74.53 10.13 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.284 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.26 155.06 9.9 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.173 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 36.1 p90 -154.81 167.14 31.24 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.831 0.852 . . . . 0.0 109.228 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -110.11 133.88 52.75 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.336 0.654 . . . . 0.0 110.035 177.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -98.77 106.13 18.36 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 165.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 51.5 tp -86.27 128.74 34.96 Favored 'General case' 0 C--O 1.22 -0.497 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 172.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -147.02 166.41 26.92 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.823 0.449 . . . . 0.0 109.802 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -109.33 141.33 41.82 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.567 0.747 . . . . 0.0 109.189 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -86.49 -168.58 2.29 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.826 0.851 . . . . 0.0 111.306 -176.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.2 m -60.23 -27.29 67.08 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.614 0.765 . . . . 0.0 112.375 -179.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.449 ' HB3' ' HG2' ' A' ' 30' ' ' GLN . 19.4 t70 -102.23 14.55 31.64 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.844 0.857 . . . . 0.0 110.494 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 62.04 17.84 9.42 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.567 1.147 . . . . 0.0 112.088 -173.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.449 ' HG2' ' HB3' ' A' ' 28' ' ' ASP . 33.5 mm-40 -71.54 141.69 50.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.474 0.71 . . . . 0.0 110.058 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -90.77 115.72 28.06 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.401 0.681 . . . . 0.0 109.879 -165.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.419 ' HB2' HD23 ' A' ' 48' ' ' LEU . 8.3 tpp180 -140.37 120.46 13.74 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.654 1.182 . . . . 0.0 108.36 -172.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -109.33 138.26 45.96 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 122.428 0.291 . . . . 0.0 110.345 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.57 132.8 54.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 173.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 13.8 tp -88.39 119.33 28.71 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -105.64 140.15 39.15 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 124.376 1.071 . . . . 0.0 109.076 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -74.24 178.5 5.09 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.373 0.669 . . . . 0.0 110.824 173.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -67.51 -17.29 68.55 Favored Glycine 0 C--N 1.35 1.35 0 N-CA-C 112.258 -0.337 . . . . 0.0 112.258 174.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -66.77 -23.52 66.08 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.781 0.833 . . . . 0.0 110.946 170.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 95.35 -7.39 68.92 Favored Glycine 0 C--N 1.349 1.27 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.443 -176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -90.35 138.75 31.28 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.102 0.961 . . . . 0.0 110.531 -174.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.1 m -69.48 123.93 22.56 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.539 0.736 . . . . 0.0 110.889 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.9 pt -111.86 -19.87 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.578 1.151 . . . . 0.0 111.007 -178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.2 tp -156.01 154.91 31.81 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -173.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 96.5 m -155.86 129.19 8.23 Favored 'General case' 0 C--O 1.212 -0.911 0 C-N-CA 125.184 1.394 . . . . 0.0 107.793 -176.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 83.2 p -72.75 -170.89 0.76 Allowed 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.677 0.671 . . . . 0.0 111.718 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -91.88 178.51 5.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.734 0.413 . . . . 0.0 110.833 165.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' ' 32' ' ' ARG . 72.8 mt -77.08 113.69 15.07 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.012 174.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -89.72 141.24 28.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.949 170.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 46.3 p -83.2 -11.61 57.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.176 0.59 . . . . 0.0 110.866 176.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.8 m -135.1 135.74 41.43 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.214 1.006 . . . . 0.0 110.285 177.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -28.16 69.61 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.871 0.868 . . . . 0.0 111.401 175.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.6 p -70.2 -31.66 69.22 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.453 0.701 . . . . 0.0 111.092 175.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.6 m -70.87 -27.99 64.24 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.611 0.364 . . . . 0.0 110.54 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.15 67.39 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.54 0.736 . . . . 0.0 111.355 178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.405 ' HA ' HG22 ' A' ' 59' ' ' ILE . 0.3 OUTLIER -74.23 -29.37 61.68 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 176.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.15 -37.27 86.85 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 166.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.41 -48.91 78.74 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.009 0.818 . . . . 0.0 113.438 -178.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 56' ' ' GLU . 10.5 tt -66.68 -33.59 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 120.878 0.371 . . . . 0.0 110.751 177.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.74 81.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.12 0.568 . . . . 0.0 110.703 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.1 m -75.55 -42.04 53.38 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.438 0.695 . . . . 0.0 111.878 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 16.9 m -66.06 -32.1 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.51 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 51.5 ttp180 -65.43 -47.06 77.51 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.417 1.087 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 36.3 t -64.1 -26.4 68.53 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.141 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.557 HD22 HD11 ' A' ' 94' ' ' ILE . 87.5 m-20 -105.88 10.85 32.35 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.921 0.888 . . . . 0.0 112.511 -174.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.4 m -65.22 -46.87 72.26 Favored Pre-proline 0 CA--C 1.564 1.492 0 CA-C-O 118.525 -0.75 . . . . 0.0 112.054 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.79 -14.13 14.1 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.719 1.613 . . . . 0.0 112.763 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -80.12 94.62 6.02 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.276 0.63 . . . . 0.0 109.454 -177.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.04 -35.6 75.46 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.702 0.801 . . . . 0.0 111.881 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -61.5 -27.34 68.52 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.776 0.83 . . . . 0.0 111.71 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -87.57 -29.76 21.03 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -171.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.576 ' HB3' ' HG ' ' A' ' 86' ' ' LEU . 14.2 p90 -115.42 125.63 53.38 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 119.448 1.022 . . . . 0.0 109.161 178.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -137.91 137.76 38.35 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.515 0.726 . . . . 0.0 110.398 -173.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.455 ' HA ' ' HD1' ' A' ' 84' ' ' PHE . 2.3 ptmm? -76.62 105.12 7.5 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.251 171.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -91.35 164.68 13.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.707 1.203 . . . . 0.0 110.737 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -127.52 123.76 36.64 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.771 0.828 . . . . 0.0 108.885 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.12 165.54 20.11 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.435 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -60.48 -26.1 66.54 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.98 0.912 . . . . 0.0 111.46 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -84.37 -4.18 58.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.826 0.85 . . . . 0.0 111.636 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.02 62.12 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 122.91 0.291 . . . . 0.0 113.075 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 32.9 mmtp -71.98 129.94 39.76 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.269 0.627 . . . . 0.0 111.446 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -77.49 144.11 37.98 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.366 177.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -151.69 169.24 22.66 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.474 ' O ' ' HA ' ' A' ' 96' ' ' SER . 20.4 m-85 -105.25 160.13 15.33 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 122.12 -0.363 . . . . 0.0 110.079 178.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -140.23 103.78 4.67 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 168.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.576 ' HG ' ' HB3' ' A' ' 72' ' ' TYR . 1.4 tt -86.65 109.24 19.05 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 168.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -87.68 154.58 20.47 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.404 1.482 . . . . 0.0 110.655 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.46 166.3 10.65 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.55 1.14 . . . . 0.0 110.008 174.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -21.49 66.56 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.524 0.73 . . . . 0.0 111.661 176.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -86.09 10.69 13.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.123 0.969 . . . . 0.0 111.404 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.0 m80 62.85 25.29 15.01 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 177.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -115.08 156.77 24.58 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.212 1.005 . . . . 0.0 109.631 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.9 mt -87.72 121.28 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 122.818 0.447 . . . . 0.0 110.108 -176.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.557 HD11 HD22 ' A' ' 65' ' ' ASN . 17.6 pt -106.15 -4.95 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.071 0.948 . . . . 0.0 110.51 174.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -154.07 139.34 6.74 Favored Glycine 0 C--N 1.345 1.071 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 84' ' ' PHE . 77.8 p -159.47 169.72 23.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.221 1.408 . . . . 0.0 108.67 -177.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 27.4 t -132.87 165.39 24.74 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.553 -0.717 . . . . 0.0 110.537 174.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -72.5 -72.97 0.21 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.94 0.896 . . . . 0.0 109.454 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.562 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 22.5 ptp -175.87 139.87 0.41 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.301 1.04 . . . . 0.0 109.993 175.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -104.71 104.16 13.91 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.46 1.104 . . . . 0.0 108.863 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.58 -39.46 84.84 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.537 0.735 . . . . 0.0 110.893 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.7 p -90.01 133.6 34.72 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.857 173.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.1 -31.76 69.48 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.55 1.14 . . . . 0.0 112.673 -172.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -66.25 -28.58 68.83 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.458 0.703 . . . . 0.0 111.764 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 41.7 m -64.25 -22.44 66.95 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.882 0.873 . . . . 0.0 112.473 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.422 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.3 ptt180 -69.01 -39.56 79.22 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.37 -50.74 13.43 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.563 0.745 . . . . 0.0 110.103 -176.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.3 m -59.47 -38.35 80.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.994 0.918 . . . . 0.0 110.959 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.82 -35.66 92.18 Favored Glycine 0 C--O 1.214 -1.115 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.252 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.429 HG23 ' HE2' ' A' ' 72' ' ' TYR . 26.4 mm -58.46 -48.3 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 CA-C-N 117.456 0.628 . . . . 0.0 110.852 176.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.64 -38.51 90.54 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.135 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.5 t -70.84 -42.96 69.47 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.01 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 70.5 t -65.78 -39.01 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.843 0.857 . . . . 0.0 110.391 179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -64.14 -39.46 94.06 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.674 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -79.23 -36.68 39.63 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.658 0.783 . . . . 0.0 112.59 -176.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -105.97 -8.84 17.38 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.074 0.55 . . . . 0.0 111.83 -169.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -67.04 -34.37 86.57 Favored Glycine 0 C--N 1.346 1.094 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 175.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.51 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 15.3 t -75.89 -5.75 47.56 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 124.01 0.924 . . . . 0.0 111.91 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.2 t -65.5 141.66 58.4 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.831 0.453 . . . . 0.0 109.808 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -121.44 8.2 10.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.342 1.057 . . . . 0.0 110.948 -172.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.2 t -97.04 115.84 28.18 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.39 131.33 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.825 0.85 . . . . 0.0 110.199 -178.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 44.9 mttp -92.32 110.28 21.67 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.631 0.772 . . . . 0.0 109.17 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -83.44 102.86 12.35 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.986 0.898 . . . . 0.0 110.159 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -91.77 -3.38 56.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.512 1.125 . . . . 0.0 110.21 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 27.0 p -73.17 109.09 6.44 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.034 0.933 . . . . 0.0 110.882 178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 87.92 24.7 34.25 Favored Glycine 0 C--N 1.347 1.163 0 CA-C-N 116.149 -0.478 . . . . 0.0 113.435 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.2 m -67.78 103.19 1.36 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.912 0.485 . . . . 0.0 111.077 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 39.2 t30 . . . . . 0 C--O 1.25 1.118 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 171.205 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 112.053 -0.419 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.2 m -112.06 145.58 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.807 0.843 . . . . 0.0 110.303 -179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 31.0 pt -72.25 127.12 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 0.0 109.532 173.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptm -163.57 161.97 24.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.885 0.474 . . . . 0.0 110.83 -172.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.08 149.82 25.52 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.878 0.871 . . . . 0.0 110.316 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 86.51 135.58 4.17 Favored Glycine 0 C--N 1.341 0.855 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.239 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 49.1 p90 -153.05 150.61 29.34 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 123.873 0.869 . . . . 0.0 110.136 -178.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -87.05 143.46 27.31 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.213 177.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -129.71 111.72 12.93 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.0 tp -79.68 98.37 6.93 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.2 m -105.92 136.22 45.95 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.241 -170.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HB3' HG22 ' A' ' 126' ' ' THR . 19.4 ptmt -94.75 133.34 38.55 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 170.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 45.9 m -79.29 179.52 7.36 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.648 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.0 t -58.2 -37.98 75.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.046 0.538 . . . . 0.0 111.458 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -92.55 22.52 4.6 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 123.811 0.845 . . . . 0.0 110.77 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 64.31 19.59 11.85 Favored 'General case' 0 N--CA 1.498 1.966 0 C-N-CA 124.513 1.125 . . . . 0.0 112.817 178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.401 ' HB2' HD12 ' A' ' 48' ' ' LEU . 88.2 mm-40 -77.59 120.75 22.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.16 0.584 . . . . 0.0 109.692 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 49' ' ' TYR . 50.1 m-85 -89.52 124.2 34.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.645 0.778 . . . . 0.0 109.594 -170.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.605 ' HB2' ' HB2' ' A' ' 46' ' ' SER . 35.9 ptt180 -157.29 158.09 35.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.353 0.661 . . . . 0.0 109.877 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.51 ' HE2' HG23 ' A' ' 122' ' ' VAL . 16.7 m-85 -91.31 141.23 29.0 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.93 0.492 . . . . 0.0 109.805 176.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.409 HG12 HG23 ' A' ' 45' ' ' THR . 19.8 m -120.67 131.26 73.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 167.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -97.34 111.8 23.89 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mttp -90.41 138.29 31.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 172.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -71.5 176.0 5.07 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.481 0.712 . . . . 0.0 110.135 169.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -60.19 -24.36 60.94 Favored Glycine 0 CA--C 1.537 1.414 0 N-CA-C 114.088 0.395 . . . . 0.0 114.088 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -81.26 0.4 36.99 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.291 1.037 . . . . 0.0 112.173 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.3 -0.71 89.55 Favored Glycine 0 C--N 1.353 1.512 0 C-N-CA 122.803 0.24 . . . . 0.0 113.599 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -88.21 130.56 35.04 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.455 0.702 . . . . 0.0 110.336 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 97.8 m -71.95 121.9 19.89 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.294 0.638 . . . . 0.0 110.287 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 36.1 pt -102.58 -32.08 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.452 1.101 . . . . 0.0 110.815 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 35' ' ' LEU . 34.6 tp -132.18 149.45 52.39 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.993 0.917 . . . . 0.0 109.662 -172.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.409 HG23 HG12 ' A' ' 34' ' ' VAL . 91.6 m -152.99 125.77 8.35 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.411 1.084 . . . . 0.0 109.462 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.605 ' HB2' ' HB2' ' A' ' 32' ' ' ARG . 5.6 m -66.97 170.79 6.2 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.011 0.924 . . . . 0.0 110.583 175.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.1 168.11 20.62 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' HB2' ' A' ' 30' ' ' GLN . 2.7 mm? -71.3 112.48 7.47 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' A' ' 31' ' ' PHE . 84.9 m-85 -104.95 137.16 43.14 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 175.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 m -73.99 -28.74 61.61 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.161 0.505 . . . . 0.0 110.092 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.497 ' HB3' HG22 ' A' ' 53' ' ' THR . 17.6 m -105.32 132.59 51.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.624 0.77 . . . . 0.0 110.151 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -26.84 62.12 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.231 0.613 . . . . 0.0 111.316 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.497 HG22 ' HB3' ' A' ' 51' ' ' SER . 9.5 t -62.09 -36.41 81.62 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 123.751 0.657 . . . . 0.0 110.89 174.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.6 m -65.83 -39.06 90.46 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 110.819 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.26 86.39 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.601 0.76 . . . . 0.0 110.455 174.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.64 -34.2 77.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.742 0.817 . . . . 0.0 110.839 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 53' ' ' THR . 64.1 mmtt -76.53 -30.33 57.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.28 -41.61 98.42 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.113 -0.949 . . . . 0.0 114.062 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.0 tt -65.66 -42.32 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 117.112 0.456 . . . . 0.0 111.035 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.11 -36.28 83.79 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.967 0.507 . . . . 0.0 110.74 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.3 m -71.66 -46.03 60.16 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.695 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 33.6 m -67.15 -28.97 44.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 118.204 0.456 . . . . 0.0 110.8 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -69.21 -38.47 78.6 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.342 0.657 . . . . 0.0 110.491 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 37.5 t -76.31 -36.83 58.12 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.855 177.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -93.0 8.44 39.89 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.18 0.992 . . . . 0.0 111.465 -176.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.493 ' OG ' ' HA ' ' A' ' 114' ' ' LYS . 16.9 t -62.33 -44.94 89.73 Favored Pre-proline 0 CA--C 1.571 1.762 0 C-N-CA 124.709 1.203 . . . . 0.0 112.222 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.81 -6.73 6.62 Favored 'Trans proline' 0 C--N 1.393 2.904 0 C-N-CA 121.845 1.696 . . . . 0.0 113.479 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -83.89 85.75 7.27 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.99 0.516 . . . . 0.0 110.112 -174.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.33 -23.3 67.35 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.864 0.866 . . . . 0.0 112.593 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -66.79 -34.9 78.84 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.649 0.78 . . . . 0.0 111.189 176.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -76.36 -20.9 56.75 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.11 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -73.21 116.21 13.48 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 171.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -96.24 98.38 10.26 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 147.43 38.82 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.946 0.403 . . . . 0.0 110.139 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -144.62 167.96 21.29 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.916 1.287 . . . . 0.0 109.129 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.4 m -126.73 114.73 18.37 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 114.914 -1.039 . . . . 0.0 108.278 173.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.11 154.7 5.33 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.855 1.262 . . . . 0.0 111.221 172.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.5 p -68.92 -12.94 62.11 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.631 0.772 . . . . 0.0 112.266 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -79.74 1.83 25.14 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.55 0.74 . . . . 0.0 111.948 170.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.48 10.59 84.3 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.172 0.295 . . . . 0.0 112.874 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -88.35 141.33 28.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.609 0.764 . . . . 0.0 110.154 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -101.77 128.56 48.05 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.964 0.506 . . . . 0.0 110.119 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.616 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 30.0 p90 -142.75 175.52 9.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -133.96 158.79 42.59 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 122.966 0.506 . . . . 0.0 110.153 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -127.05 100.72 6.24 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.505 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.27 111.54 18.44 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 173.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HE2' HG12 ' A' ' 93' ' ' ILE . 16.2 ptpt -127.93 155.37 44.32 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.558 0.343 . . . . 0.0 110.177 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.47 178.79 6.45 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.464 0.705 . . . . 0.0 110.692 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.28 -10.81 57.33 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.499 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.515 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 2.0 m-20 -80.86 5.4 16.17 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.295 1.038 . . . . 0.0 111.621 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 67.8 11.27 8.29 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.805 1.242 . . . . 0.0 111.976 -178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 4.0 pt20 -106.87 135.11 48.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.781 0.433 . . . . 0.0 110.955 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.422 HG12 ' HE2' ' A' ' 87' ' ' LYS . 55.9 mt -70.85 99.47 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.807 0 C-N-CA 123.922 0.889 . . . . 0.0 110.131 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.505 HD11 HD22 ' A' ' 86' ' ' LEU . 18.3 pt -79.05 -12.91 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.313 178.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.44 146.54 9.58 Favored Glycine 0 C--O 1.215 -1.035 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.1 p -166.7 167.16 15.45 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 117.743 0.771 . . . . 0.0 109.772 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.2 t -113.75 165.25 12.74 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -76.78 -54.57 6.45 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.616 ' HA ' ' HB3' ' A' ' 83' ' ' TYR . 26.7 ptt? 174.33 131.52 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.75 1.62 . . . . 0.0 108.402 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.549 ' HB3' ' HB2' ' A' ' 105' ' ' SER . 97.3 m-85 -98.28 156.87 16.51 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.072 0.549 . . . . 0.0 109.941 173.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.53 -52.65 64.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.822 0.849 . . . . 0.0 111.213 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 54.5 p -130.39 177.1 7.59 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.54 0.736 . . . . 0.0 110.623 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.37 -28.56 65.21 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.845 172.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -61.82 -40.58 95.79 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.292 0.637 . . . . 0.0 110.572 172.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.549 ' HB2' ' HB3' ' A' ' 100' ' ' TYR . 14.6 m -68.55 -35.64 77.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.786 178.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -68.34 -46.14 70.99 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.969 0.508 . . . . 0.0 111.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.09 -28.59 65.53 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.779 0.432 . . . . 0.0 111.357 -176.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 m -64.41 -40.58 96.06 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 168.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.68 99.63 Favored Glycine 0 C--N 1.352 1.464 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.785 175.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 40.9 mm -60.4 -48.88 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.714 0.805 . . . . 0.0 110.258 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.29 83.2 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.298 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.8 t -74.97 -37.55 61.9 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.695 -178.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.57 -30.69 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 123.288 0.635 . . . . 0.0 110.13 176.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.493 ' HA ' ' OG ' ' A' ' 66' ' ' SER . 37.9 ttpt -70.23 -45.1 67.2 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 120.929 0.395 . . . . 0.0 110.81 172.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.69 -28.74 66.1 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.847 0.859 . . . . 0.0 111.924 -177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.78 -10.23 14.79 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.654 0.781 . . . . 0.0 111.415 -174.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -74.1 -23.79 75.22 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 112.024 -0.431 . . . . 0.0 112.024 175.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 25.4 p -78.45 -0.52 29.64 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 124.285 1.034 . . . . 0.0 112.406 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.6 t -70.85 135.69 48.23 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.482 0.713 . . . . 0.0 110.847 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -90.7 -16.48 28.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 110.335 175.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 93.5 m -73.98 93.16 2.19 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.752 0.821 . . . . 0.0 110.892 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.51 HG23 ' HE2' ' A' ' 33' ' ' PHE . 2.0 p -96.63 132.99 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -126.23 106.6 9.65 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.899 0.88 . . . . 0.0 109.211 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.68 101.85 3.77 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.119 0.568 . . . . 0.0 110.86 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -76.26 -26.25 55.77 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 123.827 0.851 . . . . 0.0 109.977 169.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.52 HG22 ' HB3' ' A' ' 25' ' ' LYS . 31.3 p -62.42 143.25 57.28 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.323 1.049 . . . . 0.0 110.95 177.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.8 -10.33 18.59 Favored Glycine 0 C--N 1.342 0.904 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.825 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 34.3 p -90.69 159.48 16.35 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.318 1.047 . . . . 0.0 110.774 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 7.9 t30 . . . . . 0 C--O 1.248 1.001 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 174.943 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.604 0 N-CA-C 111.756 -0.538 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.8 m -87.37 160.9 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 123.808 0.843 . . . . 0.0 110.531 179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -64.83 154.43 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.716 0.807 . . . . 0.0 111.069 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -67.62 129.67 40.64 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.578 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.07 104.79 11.91 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -85.2 -168.84 45.24 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 116.001 -0.545 . . . . 0.0 113.257 -175.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 29.5 p90 -141.08 148.75 40.65 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 123.319 0.647 . . . . 0.0 110.368 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.434 ' HB3' ' HD1' ' A' ' 33' ' ' PHE . 85.6 m-85 -98.41 120.29 38.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.943 175.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.443 ' HG2' ' HD3' ' A' ' 123' ' ' LYS . 44.5 mt-10 -92.62 114.09 26.55 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 173.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 31' ' ' PHE . 52.4 tp -80.61 96.63 6.91 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 172.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.7 p -105.04 148.54 26.66 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 125.134 1.373 . . . . 0.0 109.826 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -102.1 160.25 14.68 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.51 0.724 . . . . 0.0 111.13 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 96.5 p -89.94 -175.46 4.6 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 166.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.3 p -64.03 -20.21 65.75 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.082 0.553 . . . . 0.0 111.338 172.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -103.01 17.67 23.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.279 1.032 . . . . 0.0 111.339 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 64.74 16.48 10.43 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.841 1.257 . . . . 0.0 112.683 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -72.96 138.51 46.13 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.074 0.549 . . . . 0.0 110.066 -179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.523 ' HB3' HD11 ' A' ' 23' ' ' LEU . 77.7 m-85 -89.43 133.95 34.31 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.129 0.972 . . . . 0.0 110.159 -166.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB2' HD13 ' A' ' 48' ' ' LEU . 24.4 ttp180 -148.75 120.72 8.21 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -172.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.434 ' HD1' ' HB3' ' A' ' 21' ' ' PHE . 23.5 m-85 -90.2 124.1 34.57 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 174.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.435 HG12 HG23 ' A' ' 45' ' ' THR . 35.4 m -111.18 131.71 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 168.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 21.7 tp -100.3 116.43 32.26 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' THR . 95.7 mttt -101.58 128.07 48.0 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 170.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.403 ' HB2' HD13 ' A' ' 43' ' ' ILE . . . -64.14 166.75 7.35 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.948 0.78 . . . . 0.0 111.349 175.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.57 -2.5 35.83 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-N 115.818 -0.628 . . . . 0.0 114.571 -177.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.4 p-10 -86.7 -14.0 43.78 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.505 0.722 . . . . 0.0 110.64 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.34 -5.64 41.55 Favored Glycine 0 C--N 1.351 1.405 0 C-N-CA 123.592 0.615 . . . . 0.0 113.758 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -97.46 139.86 32.76 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.295 0.638 . . . . 0.0 110.713 -176.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 20.5 m -67.41 143.81 56.1 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.044 0.938 . . . . 0.0 109.822 174.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.403 HD13 ' HB2' ' A' ' 37' ' ' ALA . 20.8 pt -132.43 -20.5 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.961 0.905 . . . . 0.0 111.362 -176.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 12.8 tp -152.5 149.39 28.48 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.426 0.69 . . . . 0.0 109.498 -170.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.435 HG23 HG12 ' A' ' 34' ' ' VAL . 72.1 m -148.79 117.93 6.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.197 0.999 . . . . 0.0 109.273 177.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.8 t -79.33 172.49 13.72 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.391 0.676 . . . . 0.0 111.062 177.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.42 173.64 9.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.147 0.579 . . . . 0.0 111.649 178.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 32' ' ' ARG . 3.4 mm? -82.83 111.36 18.66 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.482 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 95.6 m-85 -88.72 131.13 35.16 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.822 1.249 . . . . 0.0 109.164 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -66.49 -30.24 70.53 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.727 0.811 . . . . 0.0 111.414 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 39.6 m -125.52 143.97 50.76 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.709 0.804 . . . . 0.0 110.446 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.95 68.64 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.818 0.847 . . . . 0.0 111.017 175.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.5 p -62.05 -43.08 99.61 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.38 1.072 . . . . 0.0 110.793 176.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.482 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 8.3 m -65.52 -37.86 87.99 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.153 0.981 . . . . 0.0 110.073 178.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.9 -38.53 88.96 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.943 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.7 -39.66 94.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.08 0.552 . . . . 0.0 110.564 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.93 -37.52 86.26 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.575 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.4 76.36 Favored Glycine 0 C--N 1.35 1.334 0 O-C-N 123.878 0.736 . . . . 0.0 112.868 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.451 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.0 tt -72.04 -31.71 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 122.849 0.459 . . . . 0.0 111.118 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.42 87.24 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.99 0.516 . . . . 0.0 110.356 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.4 m -70.4 -52.14 24.51 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.955 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 59' ' ' ILE . 21.3 m -58.26 -33.05 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 122.585 0.354 . . . . 0.0 111.85 -173.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' A' ' 118' ' ' THR . 0.0 OUTLIER -66.99 -43.18 83.65 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.868 0.867 . . . . 0.0 110.799 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.6 t -69.59 -36.06 75.9 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.285 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.432 ' HB3' HD21 ' A' ' 86' ' ' LEU . 13.4 m120 -88.26 -0.42 57.1 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.027 0.931 . . . . 0.0 111.979 -174.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.656 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.5 m -55.03 -52.13 73.7 Favored Pre-proline 0 CA--C 1.565 1.534 0 C-N-CA 123.773 0.829 . . . . 0.0 112.425 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -81.26 -12.53 11.58 Favored 'Trans proline' 0 C--N 1.392 2.818 0 C-N-CA 121.914 1.743 . . . . 0.0 113.034 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -85.62 86.64 7.36 Favored 'General case' 0 C--N 1.351 0.646 0 C-N-CA 123.468 0.707 . . . . 0.0 109.979 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -62.54 -21.77 65.8 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.622 0.769 . . . . 0.0 111.459 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.539 ' HG3' ' HE ' ' A' ' 71' ' ' ARG . 11.7 tp10 -52.8 -36.28 58.11 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.319 1.448 . . . . 0.0 111.634 170.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HE ' ' HG3' ' A' ' 70' ' ' GLU . 5.1 mmp_? -90.27 0.77 57.07 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.58 0.752 . . . . 0.0 112.884 -174.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -99.48 134.13 42.8 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.911 0.484 . . . . 0.0 110.204 175.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 16.7 mm-40 -100.09 92.93 5.47 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.212 1.005 . . . . 0.0 108.363 175.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -89.1 101.36 14.02 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.745 0.783 . . . . 0.0 108.961 -176.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -136.16 173.22 11.95 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.698 0.799 . . . . 0.0 110.543 -170.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -120.98 128.01 52.32 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.744 0.817 . . . . 0.0 109.924 -176.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.0 160.43 32.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.726 0.811 . . . . 0.0 109.882 169.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.0 m -65.38 -10.96 37.7 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.196 0.598 . . . . 0.0 112.264 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -76.27 -5.18 45.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.038 0.935 . . . . 0.0 111.385 174.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.42 9.24 85.16 Favored Glycine 0 C--N 1.351 1.4 0 C-N-CA 123.306 0.479 . . . . 0.0 112.197 -174.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.426 ' HA ' ' HE3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -97.22 132.81 42.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.242 0.617 . . . . 0.0 111.115 -173.313 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.659 ' HB3' ' HD3' ' A' ' 106' ' ' ARG . 62.4 m-85 -94.59 133.89 37.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.322 1.049 . . . . 0.0 110.597 -173.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -145.31 174.8 10.79 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.86 0.864 . . . . 0.0 109.245 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 24.9 p90 -138.69 134.26 33.39 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.277 0.631 . . . . 0.0 110.198 174.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.564 ' HB3' HD12 ' A' ' 93' ' ' ILE . 95.3 m-20 -110.04 120.6 42.96 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.574 0.75 . . . . 0.0 109.402 179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.507 HD22 HD11 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.2 129.3 34.8 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -105.5 137.06 43.95 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.45 1.1 . . . . 0.0 110.448 -168.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -105.23 169.69 8.3 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.509 0.723 . . . . 0.0 110.082 173.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.59 -21.4 66.33 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.797 0.839 . . . . 0.0 111.904 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.411 ' HB2' ' HG2' ' A' ' 92' ' ' GLN . 11.5 m120 -85.79 4.67 35.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.811 0.844 . . . . 0.0 111.784 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.5 m170 70.73 -1.16 2.7 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.276 1.43 . . . . 0.0 112.82 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HG2' ' HB2' ' A' ' 90' ' ' ASN . 30.0 pt20 -75.99 149.33 37.61 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 123.168 0.587 . . . . 0.0 110.467 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 85' ' ' ASN . 41.4 mm -87.37 99.59 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.507 HD11 HD22 ' A' ' 86' ' ' LEU . 12.5 pt -79.14 -4.79 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.83 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -173.16 94.16 0.1 OUTLIER Glycine 0 C--N 1.342 0.871 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 177.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.6 p -88.52 125.87 34.98 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.418 ' HB3' ' H ' ' A' ' 84' ' ' PHE . 38.3 t -79.27 169.99 17.29 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 121.675 0.75 . . . . 0.0 110.948 -178.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -74.41 150.91 39.78 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.119 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 16.5 ptm -76.55 116.5 17.29 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.436 ' HB3' ' OG ' ' A' ' 105' ' ' SER . 62.9 m-85 -102.91 153.16 20.48 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.856 0.862 . . . . 0.0 111.291 -173.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.85 -52.39 11.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.036 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.2 p -104.18 163.87 12.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.093 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -73.01 -27.51 61.82 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.05 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -60.5 -42.13 95.7 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.445 0.698 . . . . 0.0 111.278 176.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.436 ' OG ' ' HB3' ' A' ' 100' ' ' TYR . 34.5 p -73.29 -30.79 63.64 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.198 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.659 ' HD3' ' HB3' ' A' ' 82' ' ' PHE . 27.0 ptt180 -76.87 -36.3 56.86 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.07 0.395 . . . . 0.0 111.446 178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.24 -29.87 60.35 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.884 0.373 . . . . 0.0 110.76 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.9 m -69.35 -33.88 73.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.53 167.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.22 -37.38 94.46 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.535 173.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.9 mm -59.82 -48.34 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 174.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.47 -36.23 79.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.361 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.6 t -71.25 -52.13 20.68 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.154 0.582 . . . . 0.0 110.831 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 88.9 t -61.72 -31.05 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.542 0.737 . . . . 0.0 110.928 179.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.656 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 27.6 ttpp -70.04 -39.47 75.73 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.627 0.771 . . . . 0.0 111.527 175.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.91 -47.7 43.53 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.495 0.718 . . . . 0.0 111.56 -178.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.06 -20.16 19.55 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -169.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -69.76 -27.01 73.76 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 123.322 0.389 . . . . 0.0 113.164 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.626 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 72.5 p -67.66 -30.35 69.87 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.646 0.778 . . . . 0.0 111.436 176.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.3 m -83.58 88.05 7.03 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.749 0.82 . . . . 0.0 109.89 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.87 62.53 5.71 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.54 0.686 . . . . 0.0 110.789 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.8 t -101.81 110.72 22.76 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 173.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 85.9 t -96.42 114.5 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.689 0.796 . . . . 0.0 110.846 -171.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.443 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 84.8 tttt -83.57 115.54 22.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.06 0.944 . . . . 0.0 108.483 166.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -73.86 131.69 41.75 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 0.0 110.287 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -138.91 -8.1 1.39 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.069 0.948 . . . . 0.0 110.395 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.1 p -71.84 91.51 1.17 Allowed 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 121.084 0.468 . . . . 0.0 110.211 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 115.43 -6.72 20.84 Favored Glycine 0 C--N 1.349 1.265 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.548 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.1 t -123.67 122.84 39.16 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.862 0.865 . . . . 0.0 109.665 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.563 1.452 0 C-N-CA 124.08 0.952 . . . . 0.0 112.39 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.414 0 N-CA-C 111.694 -0.562 . . . . 0.0 111.694 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.99 156.36 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.241 0.616 . . . . 0.0 110.408 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.7 pt -76.2 166.51 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.61 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 49.5 mtt -75.02 133.16 41.71 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.11 118.91 19.35 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.414 ' HA3' ' ND2' ' A' ' 116' ' ' ASN . . . 63.33 -154.3 45.03 Favored Glycine 0 C--N 1.349 1.274 0 O-C-N 123.929 0.768 . . . . 0.0 113.657 178.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 46.4 p90 -162.75 165.87 24.98 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.753 0.821 . . . . 0.0 110.683 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 69.1 m-85 -105.44 157.58 17.25 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.534 1.134 . . . . 0.0 108.731 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.494 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 74.8 mt-10 -137.18 110.09 7.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 169.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.7 tp -92.82 106.14 18.15 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 m -129.35 152.0 49.38 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HE3' ' HB ' ' A' ' 126' ' ' THR . 19.1 ptpt -106.51 148.59 28.03 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.038 0.446 . . . . 0.0 110.4 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -72.4 -178.03 2.4 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.345 1.058 . . . . 0.0 111.264 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.0 t -66.74 -29.74 69.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 122.875 0.47 . . . . 0.0 111.247 -178.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -86.52 15.15 5.78 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.026 0.53 . . . . 0.0 111.585 174.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.446 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 17.3 m120 68.68 14.03 8.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.912 1.285 . . . . 0.0 112.748 171.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -81.48 134.23 35.5 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.605 0.762 . . . . 0.0 109.272 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -86.97 140.52 29.5 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.544 0.738 . . . . 0.0 110.134 -169.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -152.72 115.7 4.6 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -93.35 138.2 31.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.56 HG12 HG23 ' A' ' 45' ' ' THR . 30.4 m -110.8 153.77 12.52 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 172.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.433 HD21 ' HB3' ' A' ' 116' ' ' ASN . 0.4 OUTLIER -117.35 123.16 45.81 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 179.443 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -119.76 146.24 45.83 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 110.359 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.544 ' HA ' HD21 ' A' ' 116' ' ' ASN . . . -75.4 -178.71 4.15 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.77 0.828 . . . . 0.0 110.552 172.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -66.14 -17.98 66.47 Favored Glycine 0 CA--C 1.537 1.411 0 CA-C-N 116.363 -0.38 . . . . 0.0 113.562 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -88.33 -2.37 58.56 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.906 0.882 . . . . 0.0 112.192 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.37 2.82 88.98 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 113.989 0.355 . . . . 0.0 113.989 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -81.68 126.76 32.17 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.029 0.531 . . . . 0.0 110.095 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 24.1 m -70.09 120.63 16.08 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 pt -100.25 -26.49 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.965 1.306 . . . . 0.0 111.016 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 20.8 tp -151.54 120.93 6.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.368 0.667 . . . . 0.0 109.395 -174.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.56 HG23 HG12 ' A' ' 34' ' ' VAL . 59.4 m -119.63 122.07 40.71 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.417 0.687 . . . . 0.0 109.543 176.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.506 ' HG ' ' HE2' ' A' ' 49' ' ' TYR . 16.5 t -73.93 -176.28 2.43 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 122.764 0.426 . . . . 0.0 110.569 176.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -91.94 178.19 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.72 0.408 . . . . 0.0 110.469 172.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.6 mp -84.47 112.42 20.36 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 -178.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.506 ' HE2' ' HG ' ' A' ' 46' ' ' SER . 82.1 m-85 -90.33 115.85 27.84 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 124.145 0.978 . . . . 0.0 108.569 170.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 39.4 p -69.97 -7.73 43.14 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.01 0.524 . . . . 0.0 111.698 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.9 m -119.33 135.31 54.78 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.546 1.138 . . . . 0.0 109.738 175.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -29.36 69.06 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.929 0.492 . . . . 0.0 110.655 174.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -63.98 -43.78 94.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.125 0.97 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.7 p -74.41 -28.27 61.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.176 0.59 . . . . 0.0 111.362 178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.58 -36.01 82.5 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.95 0.5 . . . . 0.0 110.616 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -73.17 -37.19 66.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.578 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.0 mmmp? -61.07 -39.98 91.94 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.499 172.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.01 85.24 Favored Glycine 0 C--N 1.348 1.244 0 O-C-N 123.867 0.73 . . . . 0.0 113.226 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.2 tt -71.39 -32.0 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 CA-C-O 120.925 0.393 . . . . 0.0 111.0 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.09 -30.96 70.26 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.799 0.44 . . . . 0.0 110.557 174.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.5 m -74.06 -43.32 58.22 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.087 178.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.27 -27.95 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 CA-C-N 118.276 0.489 . . . . 0.0 110.521 177.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.29 -44.32 79.53 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.648 0.779 . . . . 0.0 109.498 176.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.4 t -78.08 -26.64 48.26 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.0 0.52 . . . . 0.0 111.497 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -103.26 13.68 33.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.88 0.872 . . . . 0.0 111.381 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 57.4 p -66.92 -45.89 54.03 Favored Pre-proline 0 CA--C 1.565 1.537 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.828 173.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.29 -7.07 15.97 Favored 'Trans proline' 0 C--N 1.397 3.097 0 CA-C-N 121.873 1.705 . . . . 0.0 112.433 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -83.1 77.16 9.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.537 0.735 . . . . 0.0 110.373 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -60.6 -35.82 77.06 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.703 1.201 . . . . 0.0 112.362 -176.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -74.87 -23.9 58.47 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.272 0.629 . . . . 0.0 110.969 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -77.19 -21.37 54.04 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 123.341 0.657 . . . . 0.0 110.649 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -73.87 104.61 4.81 Favored 'General case' 0 C--N 1.356 0.886 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 167.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -96.86 113.23 24.76 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.282 0.633 . . . . 0.0 109.292 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.5 147.05 34.03 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 173.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -147.58 135.59 21.28 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.278 1.031 . . . . 0.0 108.954 -173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.7 m -98.32 125.19 43.34 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.07 164.85 26.1 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.025 0.93 . . . . 0.0 110.893 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.9 t -69.17 -26.37 64.82 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.435 0.694 . . . . 0.0 110.341 178.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -76.35 -4.64 43.33 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.43 1.092 . . . . 0.0 111.244 174.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 86.44 10.07 74.53 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.868 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -81.44 122.46 27.54 Favored 'General case' 0 C--N 1.347 0.493 0 C-N-CA 122.993 0.517 . . . . 0.0 110.306 -177.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -88.36 126.79 35.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -147.57 175.34 10.93 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -127.0 161.59 28.01 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.381 0.672 . . . . 0.0 110.503 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -140.42 124.19 17.24 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.439 1.096 . . . . 0.0 108.404 176.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.0 tp -84.57 106.59 16.25 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 172.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 91' ' ' HIS . 2.8 tmtm? -86.38 150.13 24.53 Favored 'General case' 0 CA--C 1.554 1.102 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.9 34.38 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.244 0.617 . . . . 0.0 110.365 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.53 -14.48 51.56 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.463 0.705 . . . . 0.0 111.931 177.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -85.94 14.82 5.57 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 0.0 111.475 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.419 ' HA ' ' HE3' ' A' ' 87' ' ' LYS . 71.8 m80 67.07 19.13 10.53 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.905 1.282 . . . . 0.0 112.164 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -109.76 147.45 33.2 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.682 0.793 . . . . 0.0 109.914 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.9 mm -90.12 105.37 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 170.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.7 pt -87.55 -7.87 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 115.089 -0.96 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -171.16 145.71 9.08 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 123.407 0.442 . . . . 0.0 112.605 175.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -154.45 122.38 5.92 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.205 1.402 . . . . 0.0 108.917 174.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.8 p -67.89 153.74 43.07 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 172.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -60.59 -78.59 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.815 0.697 . . . . 0.0 111.169 -174.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.409 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 24.9 ptt? -173.28 121.97 0.37 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.389 1.076 . . . . 0.0 108.966 176.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -103.27 148.94 25.21 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.71 -37.53 35.47 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.636 174.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.6 p -114.45 147.76 38.81 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.357 0.663 . . . . 0.0 111.76 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.63 -22.45 64.41 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.535 176.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -58.82 -45.11 90.73 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.69 0.796 . . . . 0.0 111.164 173.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m -73.0 -23.99 60.7 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.363 0.665 . . . . 0.0 111.29 -178.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.445 ' O ' HG12 ' A' ' 110' ' ' ILE . 23.9 mtp180 -62.69 -51.11 68.48 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.663 0.385 . . . . 0.0 110.28 168.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -66.54 -34.61 78.29 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.943 0.897 . . . . 0.0 111.061 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 28.7 m -70.32 -34.68 72.99 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.929 0.492 . . . . 0.0 109.936 174.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.484 ' O ' HG23 ' A' ' 113' ' ' VAL . . . -61.14 -50.68 64.59 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.448 173.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 106' ' ' ARG . 40.7 mm -56.4 -45.28 81.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.244 1.018 . . . . 0.0 110.065 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.84 89.5 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.821 0.848 . . . . 0.0 110.849 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.5 t -73.16 -34.94 66.33 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.763 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 109' ' ' GLY . 75.4 t -69.31 -37.28 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.139 0.576 . . . . 0.0 110.943 -178.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 66' ' ' SER . 10.4 mtmp? -69.93 -37.81 76.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.726 0.41 . . . . 0.0 110.616 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.24 -45.62 76.19 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.71 177.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.544 HD21 ' HA ' ' A' ' 37' ' ' ALA . 2.4 m-20 -85.25 -11.42 54.88 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.145 0.978 . . . . 0.0 111.588 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.07 -36.23 60.67 Favored Glycine 0 C--N 1.344 0.997 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.8 t -82.58 -2.29 53.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.321 0.648 . . . . 0.0 111.308 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.4 t -73.61 160.39 31.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.345 0.658 . . . . 0.0 110.318 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.91 2.8 3.15 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.224 0.61 . . . . 0.0 111.517 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 3.2 t -79.82 101.25 8.4 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.212 0.605 . . . . 0.0 110.019 178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.5 m -110.07 141.72 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.03 0.532 . . . . 0.0 109.795 176.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.494 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 96.6 mttt -106.66 101.48 10.93 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -80.63 107.07 13.13 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -113.88 15.31 18.6 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.153 0.981 . . . . 0.0 110.922 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.571 ' HB ' ' HE3' ' A' ' 25' ' ' LYS . 46.4 p -65.16 119.96 11.81 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.095 0.558 . . . . 0.0 111.56 -176.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 69.68 53.81 14.78 Favored Glycine 0 C--N 1.348 1.246 0 O-C-N 123.44 0.463 . . . . 0.0 113.508 171.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.1 t -75.8 84.69 2.77 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.252 1.187 0 C-N-CA 123.437 0.695 . . . . 0.0 110.111 -177.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -82.86 148.31 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.153 0.581 . . . . 0.0 110.431 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 pt -80.16 166.81 2.36 Favored 'Isoleucine or valine' 0 C--O 1.246 0.896 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 168.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 83.6 mtp -69.43 96.85 0.92 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.155 0.503 . . . . 0.0 109.717 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.18 74.01 9.65 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.745 0.783 . . . . 0.0 109.71 -177.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 144.29 142.38 3.89 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.646 -1.161 . . . . 0.0 111.771 -179.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.404 ' HA ' HG23 ' A' ' 121' ' ' THR . 43.5 p90 -157.58 155.3 29.93 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.881 0.872 . . . . 0.0 110.051 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.416 ' CE2' ' HG ' ' A' ' 35' ' ' LEU . 73.3 m-85 -98.72 140.83 32.34 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.881 0.873 . . . . 0.0 108.772 174.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.423 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 37.3 mt-10 -126.35 111.09 14.1 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 170.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 124' ' ' ASP . 21.3 tp -92.67 100.22 12.77 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.445 0.698 . . . . 0.0 109.216 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.4 t -116.34 152.61 33.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.87 0.868 . . . . 0.0 109.1 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -95.4 158.09 15.61 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 74.0 p -92.74 173.83 7.57 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.339 0.655 . . . . 0.0 110.381 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 t -69.07 -19.78 64.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.229 0.612 . . . . 0.0 109.87 170.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -87.86 9.31 22.37 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.75 0.82 . . . . 0.0 110.36 172.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 79.77 -22.07 0.3 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 125.254 1.422 . . . . 0.0 113.129 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -68.87 136.06 52.06 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.554 0.741 . . . . 0.0 111.222 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -92.38 131.07 37.85 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.932 0.893 . . . . 0.0 109.704 -170.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -147.17 121.63 9.7 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.598 0.759 . . . . 0.0 109.549 -173.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -93.07 141.97 27.81 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 HG23 ' A' ' 45' ' ' THR . 27.6 m -117.45 136.09 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.366 1.066 . . . . 0.0 109.677 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.416 ' HG ' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -91.83 115.61 28.2 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -109.72 123.92 50.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.155 0.982 . . . . 0.0 108.673 174.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.66 170.73 4.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.91 0.484 . . . . 0.0 110.959 172.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.4 -10.13 46.91 Favored Glycine 0 N--CA 1.477 1.415 0 N-CA-C 114.121 0.409 . . . . 0.0 114.121 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -78.23 -8.34 58.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.614 1.166 . . . . 0.0 110.876 175.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.06 10.88 84.36 Favored Glycine 0 C--N 1.35 1.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.883 -176.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -101.85 132.36 47.67 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.13 0.972 . . . . 0.0 109.813 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.0 m -70.17 118.32 12.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.6 pt -99.78 -16.43 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.167 0.987 . . . . 0.0 110.964 -178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.9 tp -154.65 139.1 16.8 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.546 HG23 HG12 ' A' ' 34' ' ' VAL . 40.4 m -135.29 123.44 22.94 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.8 t -79.98 177.68 8.76 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.46 0.704 . . . . 0.0 111.755 -175.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -72.36 166.68 22.04 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.236 0.614 . . . . 0.0 111.812 172.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.01 113.21 18.0 Favored 'General case' 0 C--O 1.241 0.62 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 171.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' HB3' ' HB2' ' A' ' 54' ' ' SER . 98.9 m-85 -93.66 138.73 31.58 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.423 0.689 . . . . 0.0 109.947 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t -74.69 -13.78 60.66 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.441 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 33.8 m -139.31 148.79 43.43 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.832 0.853 . . . . 0.0 110.143 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.8 tmmm? -64.63 -38.72 91.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.285 1.034 . . . . 0.0 108.678 176.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.3 p -62.85 -34.46 77.39 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.544 0.738 . . . . 0.0 111.741 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.413 ' HB2' ' HB3' ' A' ' 49' ' ' TYR . 51.0 m -64.83 -32.76 74.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.22 0.608 . . . . 0.0 111.158 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.12 -29.29 62.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.135 0.574 . . . . 0.0 111.314 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 -37.86 74.94 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.353 0.661 . . . . 0.0 110.077 173.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 57' ' ' LYS . 8.0 mtpm? -66.39 -35.01 79.24 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.956 171.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -63.31 -46.97 91.66 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.586 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.485 ' HA ' HG22 ' A' ' 62' ' ' VAL . 10.7 tt -68.16 -36.45 75.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.034 0 CA-C-N 116.952 0.376 . . . . 0.0 110.368 177.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.11 -36.03 72.3 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.012 0.525 . . . . 0.0 110.736 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.0 m -73.64 -47.82 37.13 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.43 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 59' ' ' ILE . 11.1 m -66.42 -28.71 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-N 117.708 0.231 . . . . 0.0 110.854 -178.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.628 ' HG3' ' HA ' ' A' ' 118' ' ' THR . 78.7 ttt-85 -78.22 -39.07 41.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.351 1.06 . . . . 0.0 110.684 -176.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.1 t -70.21 -35.09 73.67 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.3 175.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -97.62 4.59 50.13 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.812 0.845 . . . . 0.0 111.272 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -66.25 -46.52 61.41 Favored Pre-proline 0 CA--C 1.562 1.407 0 C-N-CA 123.904 0.882 . . . . 0.0 111.668 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.63 -18.68 32.73 Favored 'Trans proline' 0 C--N 1.393 2.914 0 C-N-CA 121.761 1.64 . . . . 0.0 112.818 173.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -95.72 97.23 9.54 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 122.957 0.503 . . . . 0.0 110.762 -172.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -21.61 66.71 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.209 0.603 . . . . 0.0 111.721 175.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.38 -33.65 21.35 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.783 1.633 . . . . 0.0 111.775 171.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -96.03 16.63 17.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.931 0.892 . . . . 0.0 112.069 -172.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -111.01 131.75 54.79 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 84' ' ' PHE . 6.4 mm-40 -96.21 97.89 9.88 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.979 0.912 . . . . 0.0 109.196 -176.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 105.41 2.75 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.901 0.751 . . . . 0.0 109.915 179.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -136.56 160.99 37.11 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.498 0.719 . . . . 0.0 110.324 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.0 m -127.57 116.48 20.41 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.725 176.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.52 153.23 13.28 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 110.858 170.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.8 t -61.65 -15.26 38.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.839 0.856 . . . . 0.0 112.452 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -86.61 11.72 12.19 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.879 0.871 . . . . 0.0 111.618 178.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.28 24.84 74.54 Favored Glycine 0 C--N 1.352 1.437 0 O-C-N 123.105 0.253 . . . . 0.0 112.738 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 34.1 mmtp -109.4 123.12 48.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.351 0.66 . . . . 0.0 110.219 -175.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -79.68 135.38 36.53 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.495 0.718 . . . . 0.0 109.905 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -151.47 140.07 20.67 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.475 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 4.0 m-85 -109.52 133.22 53.35 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.451 HD22 HD13 ' A' ' 93' ' ' ILE . 9.6 m-20 -105.63 125.38 50.91 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 176.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.456 ' HB3' HG13 ' A' ' 94' ' ' ILE . 0.6 OUTLIER -82.86 122.36 28.13 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -86.24 138.23 32.02 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.438 1.095 . . . . 0.0 109.644 -175.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.544 ' HB2' HG23 ' A' ' 94' ' ' ILE . . . -95.15 168.25 10.87 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.904 0.882 . . . . 0.0 110.37 175.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.15 -19.48 62.42 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.233 0.613 . . . . 0.0 111.051 174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.454 ' HB3' ' HG2' ' A' ' 92' ' ' GLN . 62.1 t30 -82.72 0.85 41.56 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.891 0.877 . . . . 0.0 111.543 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 69.43 18.08 7.95 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 124.688 1.195 . . . . 0.0 111.62 -176.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.454 ' HG2' ' HB3' ' A' ' 90' ' ' ASN . 4.2 pt20 -100.87 -170.49 1.85 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.634 0.774 . . . . 0.0 109.236 173.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.451 HD13 HD22 ' A' ' 85' ' ' ASN . 59.3 mt -106.63 148.01 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 175.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.544 HG23 ' HB2' ' A' ' 88' ' ' ALA . 5.6 pt -126.83 -1.15 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.25 1.02 . . . . 0.0 111.058 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 176.78 104.2 0.18 Allowed Glycine 0 C--N 1.35 1.361 0 N-CA-C 114.118 0.407 . . . . 0.0 114.118 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 m -88.83 125.87 35.1 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 171.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 98.6 p -75.81 167.37 22.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 120.76 0.314 . . . . 0.0 111.088 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -60.94 157.31 15.63 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.699 0.8 . . . . 0.0 110.613 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.408 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 25.3 ptt? -78.7 119.43 21.92 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 121.17 0.509 . . . . 0.0 109.892 178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -98.47 120.11 38.32 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.97 0.908 . . . . 0.0 109.543 -178.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.09 -35.29 71.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.992 0.517 . . . . 0.0 110.774 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 1.7 m -100.25 154.47 18.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.286 0.634 . . . . 0.0 110.413 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -84.44 -24.75 29.4 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.768 0.827 . . . . 0.0 111.851 -178.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -79.8 -32.15 40.76 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 173.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 80.1 p -67.76 -29.77 69.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.961 0.505 . . . . 0.0 111.698 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.8 ptt180 -65.98 -33.54 76.05 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.502 177.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -69.04 -42.44 76.34 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.202 0.601 . . . . 0.0 110.095 -179.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 88.4 m -69.64 -41.96 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.519 0.728 . . . . 0.0 111.062 177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -68.71 -38.1 85.32 Favored Glycine 0 C--N 1.342 0.901 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.933 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.464 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 35.5 mm -76.77 -38.82 30.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.711 0.405 . . . . 0.0 110.206 176.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.44 -26.83 68.14 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.619 0.368 . . . . 0.0 110.757 173.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 22.5 t -69.97 -46.35 65.42 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 173.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 92.6 t -59.28 -37.21 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.564 0.746 . . . . 0.0 110.796 175.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 110' ' ' ILE . 7.5 mtpm? -71.27 -33.1 69.47 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.545 0.738 . . . . 0.0 111.026 177.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.42 -51.71 14.17 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.626 0.771 . . . . 0.0 112.558 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -103.77 -4.15 24.02 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.819 0.847 . . . . 0.0 112.267 -173.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -71.74 -20.52 78.69 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.723 -0.217 . . . . 0.0 113.056 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.628 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 13.8 t -81.24 3.58 23.36 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.599 0.759 . . . . 0.0 111.596 176.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.0 t -89.93 169.3 11.34 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.766 0.426 . . . . 0.0 110.696 178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -123.35 11.09 9.3 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.797 0.839 . . . . 0.0 111.3 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 20' ' ' TRP . 6.2 t -74.46 80.94 1.93 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-O 121.739 0.781 . . . . 0.0 111.53 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 27.7 m -97.49 124.69 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.357 0.663 . . . . 0.0 110.499 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 3.7 mptp? -96.29 82.12 3.39 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 171.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 7.1 p-10 -72.56 96.77 2.01 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.021 0.915 . . . . 0.0 109.025 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -93.42 8.8 39.12 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 114.98 -1.009 . . . . 0.0 109.783 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 42.6 p -63.74 109.41 1.7 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.411 1.084 . . . . 0.0 110.095 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.39 26.72 35.2 Favored Glycine 0 C--N 1.343 0.935 0 CA-C-N 116.633 -0.258 . . . . 0.0 112.562 -174.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.9 t -151.83 154.78 36.86 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.226 1.01 . . . . 0.0 108.982 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.573 -0.727 . . . . 0.0 109.989 179.841 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 112.401 -0.279 . . . . 0.0 112.401 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.7 m -87.29 132.48 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 120.883 0.373 . . . . 0.0 110.212 176.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.5 pt -88.97 170.71 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.283 0.633 . . . . 0.0 110.508 179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 61.6 mtt -110.54 109.33 19.61 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.345 0.658 . . . . 0.0 110.097 -178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.84 73.33 10.38 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 175.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 36' ' ' LYS . . . 129.89 134.59 3.75 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.462 -176.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.435 ' HA ' HG23 ' A' ' 121' ' ' THR . 48.5 p90 -161.35 153.16 19.38 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.608 0.763 . . . . 0.0 110.786 -173.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.487 ' HB2' HG22 ' A' ' 122' ' ' VAL . 97.5 m-85 -88.51 156.74 18.92 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.463 0.705 . . . . 0.0 109.391 169.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -138.58 107.67 6.04 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 33' ' ' PHE . 37.7 tp -95.46 101.12 12.81 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.344 0.658 . . . . 0.0 109.571 -177.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.3 t -116.84 -177.74 3.27 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 123.629 0.771 . . . . 0.0 109.022 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -141.39 161.27 38.31 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 172.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.7 p -82.95 177.36 8.66 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.18 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.8 m -70.64 -22.36 62.52 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.132 0.573 . . . . 0.0 110.184 172.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.28 -5.22 48.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.841 0.856 . . . . 0.0 111.851 171.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 69.78 27.15 4.67 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.984 1.314 . . . . 0.0 111.698 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -87.15 119.66 27.61 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 170.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -88.61 142.26 27.84 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.74 0.816 . . . . 0.0 109.314 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.428 ' HD2' HD23 ' A' ' 48' ' ' LEU . 58.8 ttt180 -157.43 117.37 3.41 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 -171.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.431 ' HB3' HD13 ' A' ' 23' ' ' LEU . 46.9 p90 -98.82 133.06 43.67 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 HG23 ' A' ' 45' ' ' THR . 17.7 m -107.78 130.76 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.687 0.795 . . . . 0.0 109.05 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 20.4 tp -100.67 117.57 35.06 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' ' HA2' ' A' ' 19' ' ' GLY . 97.6 mttt -120.37 142.01 49.56 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.591 1.157 . . . . 0.0 109.516 -176.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.34 -175.92 0.87 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.067 0.947 . . . . 0.0 111.677 173.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.98 -21.76 63.94 Favored Glycine 0 CA--C 1.537 1.457 0 N-CA-C 114.5 0.56 . . . . 0.0 114.5 -176.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -84.34 -4.3 58.79 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.644 0.777 . . . . 0.0 112.533 177.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.84 8.4 87.71 Favored Glycine 0 C--N 1.343 0.943 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -82.42 132.15 35.21 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.729 0.812 . . . . 0.0 109.423 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.3 m -64.97 123.76 20.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.358 0.663 . . . . 0.0 112.007 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.484 HD11 ' HG ' ' A' ' 35' ' ' LEU . 29.9 pt -105.85 -14.45 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.141 0.976 . . . . 0.0 110.401 172.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 11.6 tp -165.59 144.49 6.26 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.795 0.838 . . . . 0.0 109.002 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.465 HG23 HG12 ' A' ' 34' ' ' VAL . 26.9 m -152.19 114.01 4.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.956 0.903 . . . . 0.0 109.221 176.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.3 m -64.26 170.17 3.99 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.212 1.005 . . . . 0.0 112.014 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.65 174.63 11.39 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 120.888 0.375 . . . . 0.0 110.21 175.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.428 HD23 ' HD2' ' A' ' 32' ' ' ARG . 66.6 mt -71.71 113.66 8.99 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.183 0.593 . . . . 0.0 109.748 177.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -90.02 137.4 32.37 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.393 0.677 . . . . 0.0 109.998 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.9 t -69.16 -21.49 63.99 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.225 0.61 . . . . 0.0 111.624 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 p -149.68 156.7 42.32 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.777 0.831 . . . . 0.0 110.371 -174.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -66.94 -28.82 68.6 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.569 177.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.9 p -59.0 -39.86 83.1 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 123.982 0.801 . . . . 0.0 110.79 176.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.9 m -71.85 -30.05 65.04 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.715 0.806 . . . . 0.0 111.383 177.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.67 -39.06 64.7 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.216 0.606 . . . . 0.0 110.986 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.73 -34.96 72.43 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.881 0.872 . . . . 0.0 110.058 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -62.07 -44.0 97.62 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.367 1.067 . . . . 0.0 109.74 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -58.84 -49.37 78.67 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.227 0.955 . . . . 0.0 113.042 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.568 ' HA ' HG22 ' A' ' 62' ' ' VAL . 14.9 tt -72.78 -33.83 45.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 122.297 0.239 . . . . 0.0 111.364 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.8 -32.07 73.39 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.901 0.48 . . . . 0.0 110.934 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.5 m -75.92 -45.45 35.1 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.509 176.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' A' ' 59' ' ' ILE . 24.1 m -66.66 -36.62 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 118.005 0.366 . . . . 0.0 111.185 -175.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.09 73.53 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.337 0.589 . . . . 0.0 110.142 -177.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 22.6 t -77.33 -32.7 55.39 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.973 0.909 . . . . 0.0 110.372 177.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.57 10.7 40.88 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.698 0.799 . . . . 0.0 111.385 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.566 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 68.6 m -58.76 -46.82 99.54 Favored Pre-proline 0 N--CA 1.484 1.251 0 C-N-CA 123.391 0.676 . . . . 0.0 112.618 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -78.18 -13.07 15.63 Favored 'Trans proline' 0 C--N 1.391 2.782 0 C-N-CA 121.559 1.506 . . . . 0.0 113.124 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -82.71 77.64 9.43 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -178.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 72' ' ' TYR . 0.4 OUTLIER -64.45 -20.66 66.31 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.979 -177.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -67.05 -37.89 84.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.767 0.827 . . . . 0.0 110.923 174.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -71.01 -23.61 62.21 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.273 0.629 . . . . 0.0 111.679 178.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.413 ' CD1' ' HA ' ' A' ' 69' ' ' GLU . 67.8 m-85 -71.63 115.33 10.69 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 107.737 -1.208 . . . . 0.0 107.737 164.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.515 ' HB3' HD22 ' A' ' 85' ' ' ASN . 36.8 tt0 -97.23 117.76 32.16 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.097 0.959 . . . . 0.0 108.865 -173.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' H ' ' HD2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -73.72 105.36 4.99 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.453 1.101 . . . . 0.0 110.633 -174.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -100.18 115.32 29.58 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.325 1.05 . . . . 0.0 109.52 -177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.0 m -112.75 111.44 22.23 Favored 'General case' 0 C--O 1.243 0.735 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB3' ' HB2' ' A' ' 81' ' ' LYS . . . -69.37 153.04 44.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.393 173.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.9 p -61.82 -21.29 64.5 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.826 0.85 . . . . 0.0 111.573 175.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -84.03 11.51 7.8 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.821 0.848 . . . . 0.0 111.493 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.48 17.25 77.71 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-N 116.447 -0.342 . . . . 0.0 113.236 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 75.5 mmtt -84.25 123.12 29.8 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -102.8 124.14 47.77 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 109.29 -0.634 . . . . 0.0 109.29 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.464 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 8.1 p90 -152.81 177.94 10.18 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.955 1.302 . . . . 0.0 108.467 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.56 157.41 44.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.507 0.323 . . . . 0.0 111.329 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.515 HD22 ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -135.61 129.97 33.71 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.112 0.565 . . . . 0.0 110.183 168.033 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.777 HD22 HD11 ' A' ' 94' ' ' ILE . 1.6 tt -81.07 115.23 20.41 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -94.11 137.59 33.13 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.805 0.842 . . . . 0.0 109.794 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -93.95 175.85 6.56 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.004 0.922 . . . . 0.0 110.74 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.73 -23.41 66.74 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.77 0.828 . . . . 0.0 111.474 175.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -84.57 5.24 28.53 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.216 1.007 . . . . 0.0 111.566 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 66.95 10.46 7.67 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.087 1.355 . . . . 0.0 112.238 -177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -89.17 148.64 23.54 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.094 0.557 . . . . 0.0 110.558 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.528 HG21 ' HB2' ' A' ' 96' ' ' SER . 54.9 mt -78.22 99.99 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 170.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.777 HD11 HD22 ' A' ' 86' ' ' LEU . 14.3 pt -81.26 -6.75 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.222 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -179.58 121.31 0.73 Allowed Glycine 0 C--N 1.347 1.148 0 CA-C-O 119.345 -0.697 . . . . 0.0 111.812 173.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.528 ' HB2' HG21 ' A' ' 93' ' ' ILE . 23.1 t -119.31 113.71 21.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.858 0.863 . . . . 0.0 110.468 177.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.5 t -65.29 161.14 20.11 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.762 0.825 . . . . 0.0 111.372 174.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -88.95 163.46 15.56 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.296 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.554 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 17.6 ptt? -73.14 120.68 19.09 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.388 0.675 . . . . 0.0 111.668 -173.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -101.11 157.12 17.01 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.208 173.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.46 -46.0 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 122.837 0.455 . . . . 0.0 111.277 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 81.5 p -101.45 153.74 19.43 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 123.27 0.628 . . . . 0.0 110.88 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.41 82.44 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.888 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -59.56 -29.94 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.417 0.687 . . . . 0.0 112.763 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.2 m -71.56 -40.48 69.95 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 112.073 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.447 ' O ' HG12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -76.21 -26.83 56.51 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 119.457 -0.306 . . . . 0.0 111.395 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -65.89 -43.13 89.14 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 122.983 0.513 . . . . 0.0 110.138 172.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.7 m -63.6 -33.9 76.63 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.897 171.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -63.34 -40.0 98.44 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.944 0.777 . . . . 0.0 113.247 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 106' ' ' ARG . 44.5 mm -60.04 -46.22 94.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 CA-C-O 121.213 0.53 . . . . 0.0 109.741 177.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.92 78.9 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.52 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 18.4 t -71.8 -43.27 65.95 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.147 0.579 . . . . 0.0 110.455 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.3 t -73.56 -24.72 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.43 0.692 . . . . 0.0 110.56 178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.566 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.7 OUTLIER -62.47 -45.88 91.04 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 172.682 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.41 -50.15 16.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.998 -175.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -84.17 -26.9 28.45 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.154 0.982 . . . . 0.0 111.178 -172.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.446 ' HA2' ' HZ ' ' A' ' 21' ' ' PHE . . . -65.41 -43.2 95.31 Favored Glycine 0 C--N 1.346 1.114 0 O-C-N 123.613 0.571 . . . . 0.0 112.797 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 46.6 p -68.56 -27.7 66.31 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.586 0.754 . . . . 0.0 111.76 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -75.28 121.81 22.75 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.425 0.69 . . . . 0.0 110.15 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.04 43.34 1.14 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.368 1.067 . . . . 0.0 111.159 -174.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.435 HG23 ' HA ' ' A' ' 20' ' ' TRP . 2.6 t -95.36 111.93 23.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.108 0.963 . . . . 0.0 108.847 176.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.487 HG22 ' HB2' ' A' ' 21' ' ' PHE . 27.0 t -134.73 135.33 53.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.245 0.618 . . . . 0.0 110.044 -174.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -91.38 95.31 9.92 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 166.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -75.12 95.03 3.01 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.689 0.757 . . . . 0.0 109.292 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -107.31 27.35 9.17 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.581 -1.191 . . . . 0.0 110.393 -178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 45.3 p -70.63 87.46 0.67 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.669 0.788 . . . . 0.0 110.814 -177.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.3 -2.9 79.13 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.153 -0.931 . . . . 0.0 113.491 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 50.6 m -77.96 97.88 5.48 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.157 0.583 . . . . 0.0 109.916 177.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 . . . . . 0 C--O 1.245 0.837 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.409 0 N-CA-C 112.216 -0.354 . . . . 0.0 112.216 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.6 m -78.84 140.67 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.508 0.723 . . . . 0.0 110.343 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 pp -82.44 130.16 36.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 122.792 0.437 . . . . 0.0 109.869 176.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 91.7 mmm -90.24 110.85 21.88 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.42 73.79 8.45 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 158.57 139.25 2.65 Favored Glycine 0 C--N 1.343 0.967 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.033 -176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -146.1 157.38 43.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 124.167 0.987 . . . . 0.0 109.581 -177.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -99.5 151.31 21.28 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.468 0.707 . . . . 0.0 110.015 174.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' HG2' ' HB2' ' A' ' 123' ' ' LYS . 48.3 mt-10 -137.29 115.05 11.33 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.431 1.092 . . . . 0.0 108.5 171.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.6 tp -80.45 98.41 7.52 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 63.3 p -94.09 155.06 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.343 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HE2' ' HA ' ' A' ' 29' ' ' ASN . 12.5 ptmm? -113.65 165.81 12.16 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.495 0.718 . . . . 0.0 109.285 171.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -102.27 -178.94 3.84 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.055 0.542 . . . . 0.0 109.955 174.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 36.4 t -65.9 -27.21 68.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.032 0.533 . . . . 0.0 110.351 171.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.24 2.87 22.75 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.78 0.832 . . . . 0.0 111.728 174.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.432 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 12.3 t30 70.35 9.64 7.03 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.876 1.27 . . . . 0.0 111.477 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -74.63 131.48 40.95 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.153 0.581 . . . . 0.0 109.997 -177.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -92.58 137.63 32.2 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.03 0.932 . . . . 0.0 110.384 -169.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -155.65 141.6 18.18 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -103.24 136.82 42.3 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 HG23 ' A' ' 45' ' ' THR . 27.7 m -107.36 132.82 53.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 175.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 44' ' ' LEU . 15.7 tp -100.22 114.98 28.82 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 171.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -103.54 141.61 35.71 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 124.395 1.078 . . . . 0.0 108.897 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.27 175.46 10.63 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.038 0.535 . . . . 0.0 110.201 171.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -68.94 -7.45 56.09 Favored Glycine 0 N--CA 1.475 1.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 113.914 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -73.17 -18.37 61.28 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.001 0.92 . . . . 0.0 111.053 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 93.61 -7.51 74.47 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.413 -173.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -88.48 136.91 32.76 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.095 0.958 . . . . 0.0 110.176 -177.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.7 m -75.78 121.41 22.52 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.014 0.526 . . . . 0.0 109.786 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 pt -97.39 -25.14 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.898 0.879 . . . . 0.0 110.839 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 14.0 tp -148.01 143.6 27.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.218 0.607 . . . . 0.0 109.963 -171.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.405 HG23 HG12 ' A' ' 34' ' ' VAL . 87.8 m -149.81 129.93 13.58 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.197 0.999 . . . . 0.0 108.806 175.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 82.4 p -78.6 170.85 16.0 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.134 0.573 . . . . 0.0 111.024 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 93' ' ' ILE . 7.9 pt-20 -70.17 170.15 12.17 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.078 0.551 . . . . 0.0 111.049 175.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.25 112.12 13.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -92.79 142.06 27.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.061 0.945 . . . . 0.0 109.761 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.7 p -72.51 -25.93 61.58 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.295 0.638 . . . . 0.0 111.022 175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.5 m -124.42 138.43 54.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.926 0.89 . . . . 0.0 110.153 -175.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -67.47 -28.12 67.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.858 0.463 . . . . 0.0 110.475 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.5 p -57.67 -40.77 80.13 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.161 0.984 . . . . 0.0 110.985 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -65.93 -35.14 79.78 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.917 0.887 . . . . 0.0 111.127 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.3 -33.15 61.17 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.44 0.696 . . . . 0.0 111.411 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -69.86 -43.54 71.66 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.631 0.773 . . . . 0.0 110.195 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.13 -22.45 52.62 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.58 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.62 -49.18 75.69 Favored Glycine 0 C--N 1.347 1.184 0 O-C-N 123.708 0.63 . . . . 0.0 112.622 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' HG22 ' A' ' 62' ' ' VAL . 6.1 tt -67.48 -33.07 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 122.699 0.4 . . . . 0.0 110.795 176.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.81 82.32 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 121.107 0.479 . . . . 0.0 110.346 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m -76.09 -39.64 54.86 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.355 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 59' ' ' ILE . 19.9 m -64.59 -33.11 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 CA-C-N 119.204 0.911 . . . . 0.0 110.495 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -70.6 -39.4 73.81 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 124.265 0.978 . . . . 0.0 110.624 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.8 t -74.14 -30.72 62.43 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.539 0.736 . . . . 0.0 110.841 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -107.55 18.35 21.59 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.786 0.835 . . . . 0.0 111.256 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.63 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 55.5 m -59.81 -49.63 90.66 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 123.398 0.679 . . . . 0.0 111.762 168.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.66 -4.65 12.97 Favored 'Trans proline' 0 C--N 1.398 3.165 0 C-N-CA 121.968 1.779 . . . . 0.0 113.098 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -92.67 81.7 4.76 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.965 0.506 . . . . 0.0 110.126 -173.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.55 -29.99 59.97 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 124.52 1.128 . . . . 0.0 112.265 176.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -63.26 -35.39 80.2 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.164 1.386 . . . . 0.0 110.514 -178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -76.14 -23.11 54.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.609 0.764 . . . . 0.0 112.117 -176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -73.91 138.63 44.4 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' ' HE2' ' A' ' 75' ' ' LYS . 73.3 mm-40 -98.97 95.34 7.08 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.7 103.68 15.38 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' HE2' ' HB3' ' A' ' 73' ' ' GLU . 56.7 mttm -124.5 157.3 35.62 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.912 0.885 . . . . 0.0 109.348 -175.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 40.5 m -127.23 115.54 19.21 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.644 0.778 . . . . 0.0 109.563 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.23 159.7 5.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.162 0.985 . . . . 0.0 111.83 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.6 p -57.69 -27.0 62.51 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.328 1.051 . . . . 0.0 112.806 -174.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -88.83 16.53 6.71 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 112.109 -179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.77 31.83 62.03 Favored Glycine 0 C--N 1.35 1.339 0 CA-C-N 116.372 -0.376 . . . . 0.0 113.335 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 99' ' ' MET . 74.7 mmtt -101.41 122.1 43.14 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.082 0.553 . . . . 0.0 109.848 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -95.2 130.86 41.76 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.484 0.714 . . . . 0.0 109.491 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.448 ' HB3' ' HA ' ' A' ' 99' ' ' MET . 45.6 p90 -149.37 161.44 42.06 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.302 0.641 . . . . 0.0 109.616 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 73' ' ' GLU . 42.2 p90 -130.91 135.9 48.1 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.206 0.602 . . . . 0.0 109.865 176.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.64 117.21 31.65 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 172.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 94' ' ' ILE . 0.8 OUTLIER -76.68 109.38 10.4 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.337 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -90.22 137.67 32.16 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.148 -1.387 . . . . 0.0 109.857 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -100.01 154.69 18.19 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.522 0.729 . . . . 0.0 109.19 169.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.03 -16.44 61.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.795 0.438 . . . . 0.0 111.434 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -74.8 1.85 11.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.474 1.11 . . . . 0.0 111.993 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 28.0 m170 68.6 14.71 9.08 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.238 1.415 . . . . 0.0 111.428 -177.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -103.86 140.86 37.09 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 123.308 0.643 . . . . 0.0 109.632 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 47' ' ' GLU . 51.2 mm -80.13 98.39 3.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.996 0.919 . . . . 0.0 108.877 176.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 86' ' ' LEU . 24.7 pt -81.99 -12.9 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.511 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -156.69 142.17 8.51 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 t -153.55 165.29 36.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.645 0.778 . . . . 0.0 109.63 175.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.1 t -143.7 148.76 36.2 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 173.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.406 ' NE2' ' HG2' ' A' ' 99' ' ' MET . 0.0 OUTLIER -68.93 -42.61 76.54 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.715 0.635 . . . . 0.0 110.483 -175.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.469 ' HB2' ' HB3' ' A' ' 81' ' ' LYS . 27.7 ptt? 176.24 155.08 0.21 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.425 1.49 . . . . 0.0 108.632 171.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -103.59 128.68 50.82 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 165.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.58 98.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.914 0.886 . . . . 0.0 111.587 -173.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 14.5 p -111.81 146.59 37.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.097 0.959 . . . . 0.0 110.425 -179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 106' ' ' ARG . . . -75.33 -16.66 60.39 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.637 0.775 . . . . 0.0 111.797 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -74.66 -33.37 62.49 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.399 0.68 . . . . 0.0 110.384 173.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 20.1 t -67.88 -20.08 65.09 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 17.2 ptt180 -55.99 -37.85 69.67 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 122.915 0.486 . . . . 0.0 110.97 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.18 -39.31 71.93 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.339 1.056 . . . . 0.0 110.127 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 23.6 m -62.82 -40.12 96.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.142 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -66.73 -47.04 70.05 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.888 -178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 43.1 mm -59.38 -45.16 93.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 122.785 0.434 . . . . 0.0 109.963 176.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.35 86.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.579 0.751 . . . . 0.0 111.423 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 19.2 t -76.05 -38.27 57.33 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.163 0.585 . . . . 0.0 111.058 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.32 -34.58 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.384 0.673 . . . . 0.0 110.538 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 66' ' ' SER . 0.9 OUTLIER -69.17 -48.66 61.62 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.48 0.712 . . . . 0.0 109.963 178.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 118' ' ' THR . . . -70.26 -51.28 31.81 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.142 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -83.53 0.21 47.51 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.453 0.701 . . . . 0.0 111.96 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.94 -30.97 72.23 Favored Glycine 0 C--N 1.347 1.147 0 N-CA-C 112.369 -0.293 . . . . 0.0 112.369 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 115' ' ' ALA . 11.5 t -85.23 0.78 50.78 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.786 -179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.1 m -67.15 108.87 2.83 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 122.905 0.482 . . . . 0.0 110.214 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -73.33 -14.61 61.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.746 0.418 . . . . 0.0 111.462 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.4 t -66.04 103.55 0.97 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.571 0.748 . . . . 0.0 110.282 176.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.51 122.37 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 123.867 0.867 . . . . 0.0 110.064 177.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.45 ' HB2' ' HG2' ' A' ' 22' ' ' GLU . 22.1 mtpp -83.05 148.36 27.59 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.078 173.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -106.24 94.83 5.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 172.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -81.89 -10.98 59.13 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.841 0.856 . . . . 0.0 111.152 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.412 ' HA ' ' HG2' ' A' ' 25' ' ' LYS . 37.8 p -63.51 89.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.363 1.065 . . . . 0.0 112.261 -174.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.38 39.0 32.08 Favored Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.72 -175.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.0 t -151.38 151.38 31.65 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.245 0.618 . . . . 0.0 110.252 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 7.1 t30 . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.085 0.954 . . . . 0.0 109.316 -179.55 . . . . . . . . 0 0 . 1 stop_ save_