data_2jyq_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 2jyq _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 ' 3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 . . . . . 0 CA--C 1.514 -0.406 0 CA-C-O 120.29 0.09 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 30.42 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.788 1.635 . . . . 0.0 113.333 -173.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 5.1 p-90 -81.38 -34.78 31.47 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.997 -173.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.55 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 1.0 OUTLIER -86.45 88.45 7.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.083 0.468 . . . . 0.0 110.462 -174.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -75.98 -30.37 58.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.759 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.3 -157.72 14.76 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.737 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -82.49 57.52 3.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.484 0.659 . . . . 0.0 111.466 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.02 134.49 26.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -73.83 165.06 25.79 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.854 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -54.94 -49.57 71.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.743 -0.208 . . . . 0.0 111.238 -177.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -61.5 -41.32 97.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.609 -175.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -61.57 -42.4 98.8 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.355 0.598 . . . . 0.0 110.019 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.2 t -67.83 -41.21 83.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.085 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -61.53 -42.19 98.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.503 0.192 . . . . 0.0 110.972 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -57.98 -35.37 71.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.334 . . . . 0.0 110.908 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -78.13 -40.94 36.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.764 HD23 HD21 ' A' ' 30' ' ' LEU . 97.2 mt -76.95 -39.21 51.44 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -174.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.01 38.16 0.27 Allowed 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.457 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 23.7 m-80 -89.51 118.75 69.34 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.23 -18.07 17.18 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.359 2.706 . . . . 0.0 113.461 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -86.58 -2.26 58.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.533 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.457 ' ND2' ' HB2' ' A' ' 21' ' ' ASN . 95.9 m-20 -84.89 131.89 47.69 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.813 0.339 . . . . 0.0 110.421 177.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -82.64 156.42 16.09 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.705 2.27 . . . . 0.0 111.919 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.47 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 33.8 ttp180 -61.64 123.32 17.57 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.096 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.51 -5.0 10.91 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.436 -175.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 87.0 m -66.06 114.38 5.17 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.908 0.416 . . . . 0.0 110.123 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.521 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 43.2 p90 -128.55 166.7 18.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.755 0.312 . . . . 0.0 111.625 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.764 HD21 HD23 ' A' ' 19' ' ' LEU . 1.7 pt? -169.11 152.03 4.94 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 6' ' ' TYR . 1.3 p -110.54 119.28 59.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.443 0.64 . . . . 0.0 111.006 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.491 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 10.5 ptp85 -102.04 151.32 22.29 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.495 178.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -93.85 117.22 29.81 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -76.71 121.4 23.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 0.0 110.946 -174.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -91.98 -16.12 26.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.059 174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 t -88.73 -13.88 38.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.627 0.727 . . . . 0.0 109.582 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.6 m -139.35 93.17 2.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.658 171.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HB3' ' HZ3' ' A' ' 38' ' ' LYS . 1.8 mmmp? -69.96 141.87 52.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.651 -173.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.54 64.96 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.872 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.35 144.2 33.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.027 0.442 . . . . 0.0 110.341 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.572 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.0 m-85 -113.52 172.78 6.76 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.2 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.491 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 39.9 t -140.01 112.16 7.64 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.786 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.534 ' HB2' HD13 ' A' ' 61' ' ' ILE . 2.4 tm? -85.33 102.34 13.3 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 173.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 t -99.51 124.67 44.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.653 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -118.22 138.15 49.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.125 0.488 . . . . 0.0 110.58 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.9 m -91.05 105.84 18.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.437 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.47 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 3.7 m-20 -88.8 169.11 11.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.189 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -143.68 123.92 13.78 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.448 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -128.13 135.51 49.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -80.94 51.84 1.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.773 0.797 . . . . 0.0 109.772 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.51 -26.29 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.282 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -114.11 -20.34 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.342 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.13 -158.32 34.5 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.9 mp -74.32 114.01 12.19 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.84 127.52 49.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.346 0.593 . . . . 0.0 110.57 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 98.6 t -86.06 121.37 37.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.056 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.567 ' HB2' ' HZ2' ' A' ' 57' ' ' LYS . 3.4 ttmp? -102.05 110.41 22.37 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.726 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -89.08 99.76 12.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.702 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.11 142.93 27.22 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 13.0 mmmm -99.42 131.58 45.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.925 -172.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.572 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -98.5 98.82 7.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.706 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.457 HH11 ' HD2' ' A' ' 62' ' ' ARG . 54.6 mtt180 -83.21 150.82 25.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.926 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -109.79 128.27 55.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.288 0.566 . . . . 0.0 111.646 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.46 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 79.3 mt -90.37 136.53 33.0 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.73 -12.25 59.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.201 0.524 . . . . 0.0 110.851 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -135.43 42.15 2.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.38 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -159.05 -70.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.804 -178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.46 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 156.87 -123.65 1.33 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.276 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -119.91 144.49 47.4 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -175.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.423 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 15.3 p90 -156.94 136.61 12.34 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.531 . . . . 0.0 110.849 175.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.426 ' HA ' ' O ' ' A' ' 60' ' ' LYS . 58.8 mt -87.11 -30.21 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.094 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.429 ' C ' ' H ' ' A' ' 74' ' ' ARG . 8.9 t -140.74 157.21 45.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.447 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.4 m -74.69 42.53 0.17 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.252 0.548 . . . . 0.0 111.575 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.429 ' H ' ' C ' ' A' ' 72' ' ' THR . 30.5 mtp85 -125.95 -71.9 0.68 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.546 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.405 HG23 ' CE2' ' A' ' 86' ' ' TYR . 0.2 OUTLIER -96.11 125.6 40.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.959 179.085 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -130.93 131.14 44.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.913 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.599 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 92.9 m-85 -130.9 146.54 52.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.705 -175.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -83.42 3.12 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 41.2 m -152.06 156.74 40.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.536 ' O ' HG23 ' A' ' 84' ' ' VAL . 92.6 mt -66.38 -43.49 85.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.835 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -58.76 -47.34 85.04 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.841 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.467 ' HB3' ' HB3' ' A' ' 77' ' ' PHE . 20.4 tt0 -56.32 -35.1 67.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.115 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.44 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 7.9 tt -69.56 -60.49 2.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.886 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -60.84 -41.54 89.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -53.84 -45.79 71.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.748 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.405 ' CE2' HG23 ' A' ' 75' ' ' THR . 66.6 t80 -71.57 -46.08 60.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.858 0.361 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.599 ' HE1' ' HE2' ' A' ' 77' ' ' PHE . 2.5 m-85 -66.55 -11.93 55.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.22 -177.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.531 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.2 t -72.34 -27.42 62.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 110.344 176.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -104.53 -48.64 3.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.351 0.596 . . . . 0.0 110.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.465 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.7 t-160 -113.54 108.23 16.89 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.93 87.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.505 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.3 t70 67.75 -67.03 0.19 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.758 174.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -110.06 -32.26 2.88 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.212 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.578 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.2 mp -69.46 155.79 39.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.063 0.458 . . . . 0.0 111.07 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 m -78.55 -19.43 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.462 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -142.43 135.04 28.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.235 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -74.37 144.85 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.006 0.432 . . . . 0.0 111.174 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 69.6 mt -56.83 109.76 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.63 -176.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.1 m -98.71 -60.09 1.61 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 -173.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.7 p-10 -134.63 147.22 50.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.749 -176.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.413 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.1 t -88.37 146.58 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -55.39 122.07 41.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 O-C-N 123.718 0.636 . . . . 0.0 111.307 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -78.02 136.14 14.51 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.29 1.994 . . . . 0.0 112.086 177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 C--N 1.322 -0.623 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.041 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.454 -0.263 0 CA-C-O 121.088 0.47 . . . . 0.0 111.823 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -52.64 -39.45 61.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.506 -1.224 . . . . 0.0 113.423 -168.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -66.08 -33.35 75.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.415 ' HA ' HG13 ' A' ' 31' ' ' VAL . 79.2 t80 -83.47 99.93 10.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.776 0.322 . . . . 0.0 110.378 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.454 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.6 m-85 -83.68 -24.07 31.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.201 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.13 -166.14 13.35 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.86 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.644 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 44.6 pttt -86.69 78.81 9.05 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.632 0.73 . . . . 0.0 111.324 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 pt -97.79 149.81 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -76.53 171.01 15.33 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.83 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -58.18 -47.81 82.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.109 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 45.5 mtp180 -56.66 -41.6 77.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.166 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.88 -52.86 46.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.063 0.458 . . . . 0.0 110.531 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 6.9 m -62.14 -55.1 32.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.553 -174.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.405 ' HG2' HG21 ' A' ' 56' ' ' VAL . 34.4 mt-10 -71.88 -22.51 61.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.094 -173.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 8.4 tpt180 -76.33 -23.23 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.059 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -88.85 -21.57 23.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.829 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.607 HD23 HD22 ' A' ' 30' ' ' LEU . 80.2 mt -93.88 -31.87 14.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.822 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 20' ' ' LEU . 3.5 mm? -77.66 53.35 1.09 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.145 0.498 . . . . 0.0 111.298 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.507 ' HB2' ' OD1' ' A' ' 24' ' ' ASN . 87.3 m-20 -113.63 128.97 25.12 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 173.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.91 -12.2 21.3 Favored 'Trans proline' 0 N--CA 1.471 0.191 0 C-N-CA 122.843 2.362 . . . . 0.0 112.866 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -83.72 -33.63 25.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.796 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 21' ' ' ASN . 4.3 m-20 -54.12 116.89 11.37 Favored Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.549 -178.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.96 151.44 24.1 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.487 2.124 . . . . 0.0 112.061 177.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -55.49 116.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.408 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.53 -2.89 9.49 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.804 -0.713 . . . . 0.0 111.958 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.511 ' HB ' ' HB2' ' A' ' 46' ' ' SER . 46.3 m -73.05 121.86 20.83 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 175.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.538 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -134.9 159.11 42.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.036 0.446 . . . . 0.0 111.873 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.607 HD22 HD23 ' A' ' 19' ' ' LEU . 2.3 pt? -155.59 137.35 14.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.97 170.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.415 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.4 p -99.8 114.48 38.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.717 0.77 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 ptt85 -115.11 160.17 19.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.575 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.644 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.9 tt0 -99.78 139.75 34.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.491 ' HB3' HG22 ' A' ' 36' ' ' THR . 45.6 m -100.11 115.77 30.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.292 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -64.32 -17.26 63.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.009 -174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.491 HG22 ' HB3' ' A' ' 34' ' ' SER . 10.6 t -61.47 -22.17 64.83 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.713 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.0 m -151.49 102.08 2.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.808 ' HB2' ' HZ1' ' A' ' 38' ' ' LYS . 4.4 ttmp? -55.61 113.36 1.42 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.095 -177.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.97 -2.2 48.01 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.612 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -100.01 112.96 25.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.77 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 75.5 m-85 -96.43 161.88 13.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.075 -177.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.53 117.7 19.12 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.83 176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.648 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -82.38 85.6 6.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.401 ' O ' HD21 ' A' ' 30' ' ' LEU . 19.2 m -74.46 111.9 10.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.907 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.8 p -107.86 136.86 41.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.006 0.431 . . . . 0.0 110.742 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.511 ' HB2' ' HB ' ' A' ' 28' ' ' THR . 15.4 m -81.04 107.55 13.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.875 176.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -102.86 147.87 26.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.849 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.547 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 88.1 t80 -133.46 113.7 12.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.404 0.621 . . . . 0.0 110.534 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -96.68 139.47 32.7 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.667 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -81.48 49.83 1.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.281 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -171.32 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.537 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -105.2 5.81 32.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.667 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.02 -146.62 38.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.138 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.547 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.1 mp -96.29 147.0 24.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 0.0 110.891 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -143.67 154.56 43.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.399 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.405 HG21 ' HG2' ' A' ' 16' ' ' GLU . 84.1 t -108.15 120.01 58.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 120.976 0.417 . . . . 0.0 111.078 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -102.14 114.42 28.54 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.688 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -89.71 86.04 6.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.052 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.402 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 49.9 m-85 -69.0 129.24 39.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.838 0.351 . . . . 0.0 110.805 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 38.9 mmtm -75.03 122.24 23.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.505 -172.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 59.2 mt -107.29 87.24 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -110.74 163.17 14.03 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.496 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 36.3 mtmm -99.29 150.17 22.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.34 0.59 . . . . 0.0 111.73 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 68.7 mt -95.56 177.11 5.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.79 -1.095 . . . . 0.0 109.993 172.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -51.23 -58.16 6.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.437 0.46 . . . . 0.0 110.897 175.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 p -142.21 14.43 2.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.045 0.45 . . . . 0.0 111.547 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -84.71 -32.96 20.33 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.348 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.494 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 110.19 -144.61 17.01 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.829 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -93.92 143.26 26.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.507 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 13.1 p90 -154.86 139.63 17.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.933 0.397 . . . . 0.0 110.74 177.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.636 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 62.1 mt -97.12 -26.27 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 122.071 0.939 . . . . 0.0 108.505 171.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.474 HG22 ' HB3' ' A' ' 92' ' ' ASP . 1.3 t -136.37 144.04 44.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.069 -1.423 . . . . 0.0 108.678 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.3 m -68.82 -15.74 63.59 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -170.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HD2' ' OD1' ' A' ' 92' ' ' ASP . 61.5 mtt85 -71.32 -58.74 3.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 0.0 110.874 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.411 HG21 ' CE1' ' A' ' 86' ' ' TYR . 25.1 m -102.54 124.08 47.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.28 -175.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -124.93 137.29 54.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.829 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -137.53 135.75 37.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.669 0.271 . . . . 0.0 110.784 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.0 m -88.38 14.18 10.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.152 0.501 . . . . 0.0 110.702 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 29.0 m -143.65 132.05 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.784 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 84' ' ' VAL . 88.6 mt -66.93 -25.29 66.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.06 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -48.11 79.09 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.95 -32.8 74.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.524 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -54.67 -64.8 0.72 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.534 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -66.64 -40.8 87.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.089 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.55 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.924 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.411 ' CE1' HG21 ' A' ' 75' ' ' THR . 60.9 t80 -93.04 -47.33 7.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.696 0.284 . . . . 0.0 111.04 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.636 ' HE2' ' HB ' ' A' ' 71' ' ' ILE . 2.8 m-85 -68.75 -9.0 48.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.035 -175.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.652 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 5.8 p -72.69 -33.37 66.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.374 0.607 . . . . 0.0 110.33 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -100.86 -39.83 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.678 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 34.3 m170 -115.47 111.99 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.93 -33.81 64.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.993 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.492 ' OD1' ' HD2' ' A' ' 74' ' ' ARG . 9.8 t70 62.9 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.566 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -101.23 -32.0 5.4 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 121.237 -0.506 . . . . 0.0 112.088 -178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.564 HD13 ' H ' ' A' ' 94' ' ' LEU . 5.0 mp -68.6 152.51 45.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 74.1 m -90.75 13.13 17.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 109.851 174.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -140.18 134.39 31.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.653 -175.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -97.78 120.22 37.78 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.652 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 63.9 mt -52.25 106.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 111.201 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.2 m -98.8 -58.47 1.94 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.269 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 p30 -135.45 151.95 50.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -90.23 146.41 6.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 120.773 0.32 . . . . 0.0 110.191 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 49.8 t -52.56 133.93 44.84 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.821 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.9 135.73 42.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.796 2.331 . . . . 0.0 111.011 173.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -177.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.667 0.27 . . . . 0.0 111.327 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.436 ' O ' HG13 ' A' ' 101' ' ' VAL . 15.6 mm-40 -50.11 -51.91 39.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.604 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.529 ' CD1' HG23 ' A' ' 84' ' ' VAL . 1.2 p-90 -84.61 -23.71 29.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.163 -173.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.4 ' HA ' HG12 ' A' ' 31' ' ' VAL . 23.0 t80 -85.18 106.73 16.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.552 -173.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.6 -21.75 26.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.878 0.37 . . . . 0.0 111.098 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.08 -163.57 12.35 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.48 -0.867 . . . . 0.0 113.489 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -83.84 56.63 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.817 0.447 . . . . 0.0 111.219 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.529 ' O ' ' HD2' ' A' ' 32' ' ' ARG . 39.5 pt -90.41 139.21 17.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.084 0.468 . . . . 0.0 110.092 177.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -78.76 177.56 8.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.755 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -55.26 -46.82 76.09 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -177.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -56.12 -48.5 76.08 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.787 -177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -59.9 -36.12 76.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.241 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -64.38 -52.83 56.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.82 0.343 . . . . 0.0 110.449 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -70.11 -29.28 66.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.648 -179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -57.75 -40.01 78.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.019 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.2 mt -88.04 -31.15 19.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.873 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.53 HD22 HD23 ' A' ' 30' ' ' LEU . 59.9 mt -82.39 -30.65 30.08 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -172.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.449 ' HA ' HD12 ' A' ' 20' ' ' LEU . 1.9 mm? -77.52 26.65 0.17 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.241 0.473 . . . . 0.0 112.216 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 19' ' ' LEU . 93.0 m-20 -99.17 120.03 59.21 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.21 -3.63 4.25 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 C-N-CA 123.42 2.747 . . . . 0.0 114.034 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -77.57 -12.68 59.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.467 . . . . 0.0 110.463 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -83.83 124.65 74.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.998 -178.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.89 151.01 27.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.56 2.173 . . . . 0.0 112.232 175.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -56.28 113.46 1.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.687 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.55 10.04 8.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.192 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 88.2 m -83.35 114.89 21.73 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.301 0.24 . . . . 0.0 110.454 176.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.463 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -122.5 162.51 21.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 111.259 -175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.53 HD23 HD22 ' A' ' 19' ' ' LEU . 2.0 pt? -159.18 128.48 5.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.541 172.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.456 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 p -94.97 121.06 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.759 0.79 . . . . 0.0 110.659 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.529 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 38.3 ptt85 -108.69 160.1 16.22 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.794 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -92.71 135.96 33.65 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -97.38 101.06 12.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.35 -34.8 58.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.942 -171.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.8 p -86.49 19.3 2.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -173.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.487 ' HB ' ' HB1' ' A' ' 40' ' ' ALA . 26.5 m -152.2 124.29 8.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.963 0.411 . . . . 0.0 110.087 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -70.32 104.75 2.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.611 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.93 5.78 65.89 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.083 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB1' ' HB ' ' A' ' 37' ' ' THR . . . -95.07 113.86 25.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.276 0.56 . . . . 0.0 110.312 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.45 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 71.9 m-85 -104.76 169.23 8.57 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.227 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.3 m -133.51 108.88 8.89 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.961 0.41 . . . . 0.0 110.542 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.456 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -83.07 84.77 7.34 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.5 t -81.27 127.82 33.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.383 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 13.9 p -125.61 138.61 53.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.0 t -78.25 119.45 21.64 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.725 0.774 . . . . 0.0 110.293 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -95.78 153.48 17.72 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.591 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -135.89 107.74 7.08 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.957 -175.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -90.77 139.81 30.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 173.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -84.13 -2.04 56.07 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -172.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -120.21 -51.22 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -84.62 -25.81 28.3 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.588 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.22 -166.69 12.17 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.081 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -79.3 146.25 33.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.104 0.478 . . . . 0.0 111.496 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -137.12 178.18 7.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.148 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 99.3 t -121.97 128.73 75.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.024 0.44 . . . . 0.0 110.306 177.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -111.26 95.53 5.58 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.547 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -76.94 91.58 3.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.458 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.479 ' HB3' HG22 ' A' ' 71' ' ' ILE . 70.4 m-85 -78.18 137.06 37.96 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -104.82 133.68 49.24 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.145 0.498 . . . . 0.0 110.982 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.721 HG12 HG12 ' A' ' 71' ' ' ILE . 66.6 mt -104.23 96.38 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.103 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.7 ttp180 -88.22 134.69 33.72 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.969 0.414 . . . . 0.0 110.421 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -82.42 127.73 33.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.773 177.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.7 mt -99.64 115.33 29.18 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.237 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.01 -25.74 67.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.326 0.584 . . . . 0.0 110.089 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -99.29 11.43 39.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.239 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.51 -102.43 0.18 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.955 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -161.78 -136.38 1.99 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.25 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -114.39 138.61 50.33 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.405 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 13.7 p90 -147.91 143.33 27.29 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.102 0.477 . . . . 0.0 110.959 177.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.721 HG12 HG12 ' A' ' 61' ' ' ILE . 57.9 mt -95.75 -36.76 6.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.159 174.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.01 148.18 52.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.365 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.447 ' O ' ' HD2' ' A' ' 74' ' ' ARG . 14.4 p -78.91 47.04 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -172.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 73' ' ' SER . 30.6 mmm180 -125.44 -62.72 1.19 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.4 m -108.93 133.4 53.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.63 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.405 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 72.6 mt-30 -129.17 135.22 48.56 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.538 0.209 . . . . 0.0 110.501 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -121.11 155.38 34.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.874 0.369 . . . . 0.0 110.867 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 p -93.41 -7.72 43.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 31.7 p -132.51 139.29 47.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.995 0.426 . . . . 0.0 110.146 177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.636 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.4 mt -68.47 -26.56 65.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.915 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -62.8 -47.3 84.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -71.23 -29.91 65.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.334 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.605 HD11 HD11 ' A' ' 71' ' ' ILE . 3.1 tm? -56.88 -62.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.045 176.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.8 m -64.35 -44.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.05 -46.28 71.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.74 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -73.78 -39.88 63.83 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.258 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.606 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 6.6 m-85 -74.0 -3.73 31.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.112 0.482 . . . . 0.0 111.536 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -82.26 -27.06 32.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 170.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.1 mttm -96.24 -49.91 5.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.807 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.606 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 35.1 m170 -125.53 119.29 27.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.2 174.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -70.45 -17.59 62.99 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.6 t70 66.55 -72.15 0.09 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.846 0.716 . . . . 0.0 111.193 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -116.31 -33.68 1.44 Allowed Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.575 HD13 ' HD2' ' A' ' 87' ' ' TYR . 5.4 mp -61.69 169.78 2.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.256 0.551 . . . . 0.0 111.057 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 41.8 t -116.35 -22.75 8.66 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.135 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.445 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 53.3 m80 -87.42 -32.02 19.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.202 -170.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 96' ' ' HIS . 49.5 mtp180 66.82 124.82 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.556 0.535 . . . . 0.0 110.018 -168.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.463 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 82.5 mt -61.03 104.45 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.607 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.6 m -96.02 -66.02 0.93 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.304 -173.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.405 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.9 p30 -133.02 150.13 52.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 5' ' ' TRP . 2.7 t -89.91 145.72 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.1 t -46.33 130.38 7.77 Favored Pre-proline 0 C--O 1.234 0.256 0 O-C-N 123.99 0.807 . . . . 0.0 112.308 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.45 151.5 82.94 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.043 2.495 . . . . 0.0 111.916 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 C--N 1.318 -0.769 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.573 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 110.599 -0.148 . . . . 0.0 110.599 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -45.01 -48.44 11.57 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.465 ' HE3' HG11 ' A' ' 31' ' ' VAL . 7.7 p-90 -81.84 -43.03 18.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.651 0.262 . . . . 0.0 111.447 -178.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.434 ' HA ' HG12 ' A' ' 31' ' ' VAL . 1.9 t80 -85.68 87.41 7.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.359 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 7.7 m-85 -67.04 -41.15 87.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.822 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.32 -165.61 18.41 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.752 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 pttm -84.29 73.65 10.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.506 0.669 . . . . 0.0 111.587 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.8 pt -94.61 144.99 8.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.986 175.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -84.23 177.53 8.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.244 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.459 ' HB3' ' OE2' ' A' ' 16' ' ' GLU . 25.1 mtp180 -56.08 -50.15 71.8 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -52.86 -37.51 60.43 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.365 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -79.45 -47.57 15.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.1 m -61.38 -49.24 77.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.984 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.459 ' OE2' ' HB3' ' A' ' 12' ' ' ARG . 42.1 mt-10 -68.27 -30.02 68.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.978 -177.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -59.89 -52.01 67.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.039 0.447 . . . . 0.0 110.858 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.636 HD21 ' OG1' ' A' ' 104' ' ' THR . 79.0 mt -70.12 -33.8 72.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.512 -174.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.767 HD22 HD22 ' A' ' 30' ' ' LEU . 55.1 mt -79.76 -32.9 41.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mp -81.27 8.78 8.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.79 0.328 . . . . 0.0 111.327 177.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.796 HD21 ' HG2' ' A' ' 23' ' ' GLU . 7.0 t30 -67.52 126.68 92.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 175.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.54 23.66 0.17 Allowed 'Trans proline' 0 N--CA 1.478 0.597 0 C-N-CA 123.493 2.795 . . . . 0.0 115.514 -167.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.796 ' HG2' HD21 ' A' ' 21' ' ' ASN . 11.3 pt-20 -122.34 10.35 9.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.312 0.577 . . . . 0.0 110.063 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -96.83 122.12 57.62 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.274 -177.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.405 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 83.6 Cg_endo -86.72 169.58 7.89 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.898 2.399 . . . . 0.0 111.758 173.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -61.89 112.2 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.591 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.69 2.8 6.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.399 -177.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 35.1 m -80.42 118.51 22.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CG ' HD21 ' A' ' 98' ' ' LEU . 28.7 p90 -129.78 165.83 21.14 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -173.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.767 HD22 HD22 ' A' ' 19' ' ' LEU . 1.8 pt? -164.64 145.84 8.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.3 171.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -108.15 124.45 64.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.328 0.585 . . . . 0.0 110.961 178.704 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.542 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 5.2 ptp180 -102.25 158.3 16.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.224 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -91.29 101.38 14.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' ALA . 34.5 t -73.93 111.78 9.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.111 0.481 . . . . 0.0 110.827 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.19 59.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 175.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 m -64.44 -36.33 83.83 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.813 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.9 m -147.6 109.46 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.325 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.59 132.84 53.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 92.01 1.74 69.76 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.827 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . -125.27 116.26 21.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.018 0.437 . . . . 0.0 109.864 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.663 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 90.4 m-85 -97.05 176.49 5.93 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.542 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 41.2 t -135.45 112.78 10.57 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.761 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.52 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.1 tm? -87.05 88.31 7.67 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.451 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 15.4 m -82.35 116.11 21.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.968 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 p -110.51 130.89 63.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.082 0.468 . . . . 0.0 110.038 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.51 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 41.4 t -78.24 122.58 25.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.341 177.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -116.87 123.68 47.63 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.943 -174.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.506 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 51.9 t80 -101.84 72.82 1.37 Allowed 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.497 ' HB2' ' HG2' ' A' ' 52' ' ' LYS . 15.5 m-20 -61.1 124.45 20.58 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.633 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.438 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.9 OUTLIER -75.26 53.1 0.63 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.567 0.699 . . . . 0.0 110.834 -179.456 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -162.22 -51.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.742 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.497 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 10.0 ptpp? -99.28 -23.58 15.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.173 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 97.89 -158.72 20.78 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.366 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.506 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 35.4 mt -64.55 120.67 12.78 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.403 0.621 . . . . 0.0 111.343 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' ND2' ' HD2' ' A' ' 52' ' ' LYS . 8.1 p30 -143.1 146.35 33.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.453 176.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.3 t -89.14 119.71 36.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.623 ' HZ1' ' HB2' ' A' ' 57' ' ' LYS . 3.5 ttmp? -95.99 100.81 12.44 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -80.07 89.84 5.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.303 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -78.5 142.85 37.12 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -115.01 117.38 30.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.178 0.514 . . . . 0.0 110.76 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.663 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 63.5 mt -87.86 92.74 3.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.792 -178.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -100.2 144.01 29.73 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.911 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.67 157.77 19.0 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.791 -0.363 . . . . 0.0 110.056 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 7.7 mt -70.1 -91.69 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.956 176.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -134.16 -34.37 0.98 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.6 t -149.07 -31.13 0.24 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.068 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.48 68.57 0.36 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.51 -1.329 . . . . 0.0 113.519 -172.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -178.28 94.6 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.758 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -83.05 125.41 31.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.435 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 15.8 p90 -126.06 132.72 51.89 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.498 0.666 . . . . 0.0 111.768 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.574 HG23 HD13 ' A' ' 94' ' ' LEU . 65.4 mt -93.35 -39.69 11.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 168.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -121.16 179.79 4.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.891 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.0 t -73.18 -43.74 60.94 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -69.54 -56.71 6.58 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -170.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.431 ' HB ' ' CE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.68 120.59 32.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -169.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.43 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 2.2 mp0 -111.99 131.8 55.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.788 170.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.463 ' CE2' ' HE1' ' A' ' 87' ' ' TYR . 98.9 m-85 -123.28 131.34 53.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.636 0.255 . . . . 0.0 110.465 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.29 5.23 27.54 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.86 0.362 . . . . 0.0 111.783 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.1 m -147.7 137.54 22.74 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.961 0.41 . . . . 0.0 110.404 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 84' ' ' VAL . 86.8 mt -72.75 -30.13 63.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.427 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -48.5 81.55 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -62.79 -35.72 80.79 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.565 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.46 HD11 HD12 ' A' ' 71' ' ' ILE . 2.8 tm? -58.34 -60.94 2.99 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.825 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -65.17 -44.13 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.48 -39.6 70.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.876 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -73.76 -48.52 31.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.592 0.235 . . . . 0.0 111.018 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.507 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 2.4 m-30 -69.99 -10.79 59.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.356 -177.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.511 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 10.7 t -70.28 -19.57 63.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.247 0.546 . . . . 0.0 110.132 176.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -116.15 -52.41 2.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.852 177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.507 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.1 t-160 -116.8 103.48 10.37 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.485 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' A' ' 97' ' ' ARG . . . -68.81 -27.34 65.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 -177.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.5 t70 70.11 -73.74 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.5 174.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.46 -49.57 2.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.794 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.587 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.3 mp -60.85 144.57 52.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.069 0.461 . . . . 0.0 110.643 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.9 t -74.6 -39.13 62.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -89.56 121.59 31.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.142 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.595 ' HA ' ' HB3' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -81.61 146.65 29.98 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.566 HD21 ' CG ' ' A' ' 29' ' ' PHE . 73.9 mt -69.04 85.68 0.35 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.218 0.532 . . . . 0.0 110.416 -177.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.7 m -78.17 -58.7 3.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.335 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.7 p-10 -132.94 143.74 49.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.949 -177.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.477 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -82.7 152.27 4.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.78 140.15 81.44 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.31 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.12 176.47 3.84 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.67 2.247 . . . . 0.0 111.167 172.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.636 ' OG1' HD21 ' A' ' 18' ' ' LEU . 24.0 p . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 123.463 0.705 . . . . 0.0 110.797 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 52.8 mm-40 . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -61.55 -52.46 64.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.002 0.429 . . . . 0.0 110.066 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 14.9 p-90 -79.79 -41.06 27.27 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.038 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.577 ' HE1' ' CE2' ' A' ' 41' ' ' TYR . 80.0 t80 -85.66 95.57 9.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.929 -177.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.571 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 30.6 m-85 -79.92 -20.96 44.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.209 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.76 -164.34 21.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.974 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.651 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 7.3 pttm -81.72 74.95 8.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.117 0.484 . . . . 0.0 111.846 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.651 HG13 ' HD2' ' A' ' 32' ' ' ARG . 39.4 pt -97.41 145.21 9.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -75.08 165.68 24.85 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.447 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 57.9 mtm180 -56.84 -51.0 70.72 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.104 0.252 . . . . 0.0 110.468 -176.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -49.48 -48.85 47.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.661 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.55 -47.58 84.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.299 0.571 . . . . 0.0 110.335 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 45.2 t -64.29 -47.3 80.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.326 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HA ' HG21 ' A' ' 56' ' ' VAL . 48.3 mt-10 -68.96 -34.75 75.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.589 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.4 -25.05 68.11 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.489 . . . . 0.0 110.336 177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -88.07 -39.37 14.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.519 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.487 HD22 HD23 ' A' ' 30' ' ' LEU . 88.4 mt -77.02 -25.46 52.64 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.4 mm? -77.54 4.4 11.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.426 ' C ' ' H ' ' A' ' 23' ' ' GLU . 43.6 t30 -83.14 109.77 19.41 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.1 Cg_exo -65.67 14.39 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.883 3.055 . . . . 0.0 114.409 -170.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.426 ' H ' ' C ' ' A' ' 21' ' ' ASN . 14.1 mm-40 -83.54 -3.67 57.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.785 0.326 . . . . 0.0 110.51 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -110.96 143.22 27.84 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.541 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -82.0 164.41 17.7 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 123.09 2.527 . . . . 0.0 112.458 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.472 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 54.4 ttp180 -68.82 106.25 2.62 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.868 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.93 2.92 2.08 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 -174.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 68.8 m -76.64 132.46 39.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.198 -0.501 . . . . 0.0 109.757 175.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.548 ' CG ' HD22 ' A' ' 98' ' ' LEU . 31.0 p90 -137.04 166.33 23.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.158 0.504 . . . . 0.0 112.002 -175.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.571 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.3 pt? -162.51 141.9 9.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.391 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.563 ' HB ' HD21 ' A' ' 43' ' ' LEU . 2.6 p -108.75 118.16 55.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.502 0.668 . . . . 0.0 110.666 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.651 ' HD2' HG13 ' A' ' 10' ' ' ILE . 11.3 mtm180 -104.58 162.07 13.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.179 -177.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.651 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.2 tt0 -97.63 129.91 44.69 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 174.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.2 m -67.85 140.98 56.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.519 0.676 . . . . 0.0 111.317 -176.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.74 -38.5 91.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.83 -177.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.6 p -103.21 -66.65 0.93 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.563 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.2 m -70.74 99.33 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.152 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.25 133.35 37.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.945 0.402 . . . . 0.0 109.923 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.69 -11.16 61.06 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -173.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.541 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -104.15 126.46 51.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.577 ' CE2' ' HE1' ' A' ' 6' ' ' TYR . 60.3 m-85 -117.34 143.33 46.07 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.175 0.512 . . . . 0.0 111.09 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.7 m -99.16 94.13 6.34 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 -176.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.686 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.2 tm? -81.24 98.38 8.07 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 172.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.7 m -97.86 132.83 43.11 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.729 -175.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.47 HG22 HD21 ' A' ' 94' ' ' LEU . 3.0 t -112.61 139.44 37.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.927 -177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.4 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 78.6 p -77.41 96.73 4.74 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.708 0.766 . . . . 0.0 109.388 174.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.81 138.81 31.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.596 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.472 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 79.7 t80 -122.59 122.45 38.88 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.302 0.572 . . . . 0.0 110.972 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -106.59 152.53 23.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.146 173.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -84.13 -1.92 55.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.746 0.307 . . . . 0.0 111.289 -173.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -123.2 -44.64 2.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.883 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -82.06 -25.52 34.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.164 -177.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.76 -141.58 17.25 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.815 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 78.5 mt -82.86 137.5 34.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.249 0.547 . . . . 0.0 111.322 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -146.4 154.83 42.08 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.467 HG21 ' HA ' ' A' ' 16' ' ' GLU . 58.3 t -97.83 115.56 38.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.966 -178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -89.98 105.72 18.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.679 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -86.7 107.26 18.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.885 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.605 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 4.0 m-85 -95.85 135.0 38.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.959 0.409 . . . . 0.0 110.713 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -95.34 102.7 14.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.932 HG12 HG12 ' A' ' 71' ' ' ILE . 54.8 mt -82.24 87.01 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.1 mtm180 -86.01 156.07 20.6 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -107.94 155.49 20.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.297 0.57 . . . . 0.0 111.328 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 95.7 mt -108.18 141.21 40.27 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.912 -1.04 . . . . 0.0 108.868 172.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -64.3 -25.42 68.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.6 t -135.44 45.03 2.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.099 0.476 . . . . 0.0 110.13 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.09 -77.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.44 -157.03 28.62 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.005 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.447 ' HB3' ' CG2' ' A' ' 61' ' ' ILE . 73.5 m-85 -99.36 136.28 39.53 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.488 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 52.3 p90 -140.04 137.65 34.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.243 0.544 . . . . 0.0 111.078 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.932 HG12 HG12 ' A' ' 61' ' ' ILE . 45.2 mt -82.63 -26.73 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.898 0.856 . . . . 0.0 109.385 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 74' ' ' ARG . 8.8 t -155.59 167.87 28.98 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.269 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.9 t -80.71 54.39 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.686 0.755 . . . . 0.0 109.738 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.603 ' HB2' HG23 ' A' ' 72' ' ' THR . 13.7 mmm180 -126.34 -78.64 0.59 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.539 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.0 m -105.04 131.72 52.19 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.488 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 73.9 mt-30 -126.43 125.62 42.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.759 0.314 . . . . 0.0 110.8 -176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -121.54 141.11 51.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.312 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -78.49 -0.92 31.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -174.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.6 m -153.48 161.38 42.31 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.405 ' O ' HG21 ' A' ' 84' ' ' VAL . 96.0 mt -81.21 -19.8 42.46 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -168.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.6 tp60 -68.2 -45.19 74.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.632 ' HA ' HE21 ' A' ' 82' ' ' GLN . 0.0 OUTLIER -59.48 -32.86 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.898 175.059 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.412 HD13 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -59.64 -63.92 1.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.413 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.405 HG21 ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -64.16 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -176.338 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.72 -32.87 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -90.42 -44.58 9.55 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.223 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.565 ' HD2' HD13 ' A' ' 94' ' ' LEU . 16.1 m-85 -74.6 -7.16 52.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.562 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 23.0 p -79.26 -21.39 46.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.156 0.503 . . . . 0.0 109.707 172.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -100.96 -47.82 4.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.057 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.515 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 93.3 m-70 -127.14 117.79 23.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.446 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -67.55 -29.77 69.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.076 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.5 t70 64.75 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.561 0.538 . . . . 0.0 112.442 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -93.53 -34.84 6.44 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.605 ' HG ' ' CE2' ' A' ' 59' ' ' TYR . 4.0 mp -72.14 159.08 34.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.33 -0.435 . . . . 0.0 110.204 174.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 18.3 t -103.54 2.4 33.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.763 0.792 . . . . 0.0 108.877 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -123.91 112.05 16.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.311 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.9 ptt180 -68.49 136.48 53.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.4 mt -60.33 97.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.376 0.423 . . . . 0.0 109.977 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 11.2 m -89.68 -46.9 8.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.076 0.465 . . . . 0.0 111.291 -172.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.5 p-10 -146.92 154.17 40.98 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.703 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.9 t -91.62 155.37 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -177.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.3 120.22 24.61 Favored Pre-proline 0 C--O 1.236 0.347 0 O-C-N 123.535 0.522 . . . . 0.0 111.865 -177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -69.58 139.35 40.63 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 111.383 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -177.907 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 121.215 0.531 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -76.65 -42.94 40.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.525 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -75.26 -37.0 61.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.301 -172.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -86.35 105.23 16.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 0.0 110.68 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.48 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 22.7 m-85 -90.8 -11.41 39.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.32 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.74 -158.21 24.98 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.674 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 66.03 4.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.84 141.92 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.6 p -84.99 170.35 13.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.913 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -54.43 -51.06 66.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.702 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 35.7 ttp180 -53.37 -40.23 64.82 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.511 0.507 . . . . 0.0 110.793 -177.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -68.19 -53.61 23.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.2 m -61.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.235 -177.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.19 -24.04 63.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.208 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 38.6 ttp-105 -62.8 -37.97 88.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.789 176.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.31 -33.71 32.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.17 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.623 HD23 HD23 ' A' ' 30' ' ' LEU . 92.2 mt -78.87 -31.55 45.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -172.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.61 10.64 3.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 23' ' ' GLU . 5.4 m-20 -86.55 125.36 67.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-O 120.716 0.294 . . . . 0.0 110.329 175.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 14.3 Cg_exo -69.88 8.48 0.79 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.3 2.667 . . . . 0.0 112.57 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.409 ' H ' ' C ' ' A' ' 21' ' ' ASN . 29.2 mt-10 -82.43 -15.6 52.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.779 177.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -92.34 133.5 29.82 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.945 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HG2' ' ND2' ' A' ' 100' ' ' ASN . 57.5 Cg_endo -73.61 144.28 35.44 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.858 2.372 . . . . 0.0 111.631 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.574 ' HD3' ' O ' ' A' ' 48' ' ' PHE . 43.6 ttp180 -52.68 114.35 1.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.486 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.58 7.07 6.39 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.432 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 51.7 m -72.19 116.43 12.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.0 110.872 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.532 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.8 p90 -126.61 165.99 18.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.926 0.393 . . . . 0.0 111.203 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.623 HD23 HD23 ' A' ' 19' ' ' LEU . 2.1 pt? -164.0 142.49 7.48 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 171.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -106.68 124.24 62.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.674 0.75 . . . . 0.0 110.775 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.433 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 15.8 ptt180 -115.14 147.69 39.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.249 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -78.7 121.58 24.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.131 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.8 m -96.62 119.72 35.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.271 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.55 -22.71 40.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.073 -174.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.0 m -69.37 -21.88 63.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.009 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.561 HG23 ' H ' ' A' ' 39' ' ' GLY . 97.4 m -149.92 120.3 7.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.451 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -81.16 15.22 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.206 0.527 . . . . 0.0 111.34 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.561 ' H ' HG23 ' A' ' 37' ' ' THR . . . -134.2 22.48 3.77 Favored Glycine 0 C--N 1.307 -1.048 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.065 -176.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.35 108.75 2.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.791 0.329 . . . . 0.0 111.339 -178.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.656 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 35.3 m-85 -85.93 152.77 22.69 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 170.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.433 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -109.79 105.81 15.17 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.674 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -90.33 91.82 8.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 173.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -87.48 107.83 18.75 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.973 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.1 p -108.15 130.69 60.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.993 0.425 . . . . 0.0 110.475 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 42.7 t -87.36 124.2 33.13 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.628 0.727 . . . . 0.0 109.918 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.416 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 12.3 t70 -120.42 135.41 55.05 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.093 -176.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.574 ' O ' ' HD3' ' A' ' 26' ' ' ARG . 75.0 t80 -116.74 149.07 40.48 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.801 -178.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.498 ' HB3' ' HB3' ' A' ' 52' ' ' LYS . 16.7 t70 -140.93 146.37 37.31 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -73.4 -13.87 61.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.3 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.52 -37.67 2.75 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.554 ' HB3' ' HZ2' ' A' ' 52' ' ' LYS . 6.9 ttpm? -83.87 -25.23 30.42 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.862 0.363 . . . . 0.0 111.358 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.68 -164.98 34.75 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.929 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.9 mt -76.45 139.23 40.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.56 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -150.63 143.1 24.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.036 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.23 119.79 57.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.073 0.464 . . . . 0.0 110.4 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 44.0 mttm -94.19 99.46 11.71 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.67 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -80.99 86.81 6.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.319 -0.401 . . . . 0.0 109.93 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.496 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 45.5 m-85 -75.91 141.99 42.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.075 0.464 . . . . 0.0 110.885 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -98.69 109.36 22.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.778 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.791 HG12 HG12 ' A' ' 71' ' ' ILE . 54.3 mt -84.02 92.09 2.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.498 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -76.57 146.68 38.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.73 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.841 ' HE2' ' HA ' ' A' ' 65' ' ' ASP . 21.2 ptmt -110.89 148.54 32.23 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.207 0.527 . . . . 0.0 110.602 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.1 mt -90.13 26.98 1.73 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.666 173.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.841 ' HA ' ' HE2' ' A' ' 63' ' ' LYS . 13.4 t70 63.91 -66.26 0.11 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.879 -174.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 54.9 m -125.04 -11.71 7.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -177.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -79.45 -18.13 74.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.834 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.5 -170.43 23.03 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.154 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -120.45 138.41 53.81 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.635 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 38.5 p90 -143.81 130.16 19.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.36 0.6 . . . . 0.0 111.569 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.791 HG12 HG12 ' A' ' 61' ' ' ILE . 69.5 mt -77.97 -42.7 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.138 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 74' ' ' ARG . 2.5 t -115.45 151.33 34.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.13 174.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.2 p -76.06 21.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.951 0.405 . . . . 0.0 112.045 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.427 ' H ' ' C ' ' A' ' 72' ' ' THR . 40.6 mmt180 -104.69 -52.66 2.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.244 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.3 m -125.19 112.03 15.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.047 0.451 . . . . 0.0 111.714 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.635 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -109.85 150.87 27.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.354 176.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.472 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 88.0 m-85 -128.45 149.69 50.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.2 m -76.96 -12.05 59.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.212 0.529 . . . . 0.0 110.993 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 16.7 m -138.06 136.6 36.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.998 -177.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.547 ' O ' HG21 ' A' ' 84' ' ' VAL . 91.8 mt -69.83 -22.32 63.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.981 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -48.55 76.29 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.86 -34.76 78.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.413 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -55.2 -62.38 1.71 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.504 178.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.547 HG21 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -63.32 -41.63 93.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.856 -176.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.3 71.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.22 -43.04 65.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.207 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.601 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 5.8 m-85 -75.83 -2.11 28.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.138 0.494 . . . . 0.0 111.468 -176.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.0 t -78.96 -21.17 47.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.352 0.596 . . . . 0.0 109.392 172.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -109.13 -49.5 3.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.979 177.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.601 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 76.0 m-70 -111.65 101.11 9.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.5 177.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.588 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -69.97 -33.97 72.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 t70 62.94 -82.79 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.249 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.17 -42.38 8.75 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.707 -0.557 . . . . 0.0 111.707 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.588 ' HB2' ' HB2' ' A' ' 91' ' ' ALA . 5.3 mp -63.04 143.17 58.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.244 0.545 . . . . 0.0 110.939 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.0 -17.81 60.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -140.32 132.71 28.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.314 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.566 ' HD2' ' H ' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -69.19 142.54 54.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.929 -179.658 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.532 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -60.87 109.77 1.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.169 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -98.97 -51.49 3.84 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -171.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 28' ' ' THR . 7.7 p30 -145.0 148.95 34.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.0 t -89.24 143.81 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.422 ' HA ' ' CG2' ' A' ' 28' ' ' THR . 51.4 t -55.81 126.54 65.54 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.058 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 20.6 Cg_exo -65.95 129.69 22.61 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.713 2.275 . . . . 0.0 111.162 174.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 C--N 1.319 -0.717 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.978 -178.877 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.6 mm-40 . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 28.19 -78.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 125.461 1.726 . . . . 0.0 114.342 -170.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 10.7 p-90 -76.77 -35.56 57.63 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.546 -174.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.435 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 88.3 t80 -94.93 99.99 11.92 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.202 -176.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HD2' ' HB2' ' A' ' 30' ' ' LEU . 42.2 m-85 -88.81 9.04 26.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.879 0.371 . . . . 0.0 111.923 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.01 -144.71 22.03 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.991 174.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -100.14 68.86 1.47 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.392 0.615 . . . . 0.0 111.636 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.0 pt -90.77 137.38 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.473 172.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -73.35 165.97 24.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.592 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.526 ' HD3' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -60.46 -37.8 82.15 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.581 -173.119 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.526 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 28.2 tpt180 -66.02 -40.32 90.98 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.528 -178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.57 -45.84 88.63 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.987 0.422 . . . . 0.0 110.598 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -61.94 -48.88 78.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.814 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -67.93 -33.52 74.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.891 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 tpt85 -58.13 -29.14 65.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.018 0.437 . . . . 0.0 110.505 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.95 -38.99 14.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.953 177.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.594 HD21 HD22 ' A' ' 30' ' ' LEU . 76.8 mt -74.88 -20.05 59.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -174.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.23 14.46 3.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.593 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 27.0 t30 -62.58 115.07 14.29 Favored Pre-proline 0 C--N 1.33 -0.253 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 170.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 29.0 Cg_exo -62.66 -0.42 1.95 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.402 2.734 . . . . 0.0 114.281 -171.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -112.26 1.63 16.22 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.318 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.593 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 92.2 m-20 -66.74 128.7 93.98 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 10.0 Cg_exo -70.61 142.44 44.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.845 2.363 . . . . 0.0 111.285 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.412 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 47.8 ttp180 -64.81 110.95 2.58 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.88 2.61 6.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.688 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 58.7 m -75.28 118.12 17.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.532 ' CG ' HD21 ' A' ' 98' ' ' LEU . 32.4 p90 -124.57 161.31 26.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.123 0.487 . . . . 0.0 112.117 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.626 ' HB2' ' HD2' ' A' ' 7' ' ' PHE . 1.8 pt? -161.44 138.88 8.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 0.0 108.979 170.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.478 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.6 p -106.51 125.64 62.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.679 0.752 . . . . 0.0 111.09 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.417 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 24.8 ptt85 -116.15 150.01 38.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.317 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -88.31 127.22 35.47 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.1 m -79.9 110.26 15.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.13 0.49 . . . . 0.0 110.985 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -25.06 61.32 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.6 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.86 -3.77 58.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.689 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.5 m -155.0 94.75 1.67 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.576 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -84.84 38.75 0.72 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.716 0.769 . . . . 0.0 110.993 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.01 12.91 4.73 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.186 -1.165 . . . . 0.0 110.186 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.555 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -163.0 142.13 8.66 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.936 -0.632 . . . . 0.0 110.382 -175.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.551 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 50.8 m-85 -109.15 179.3 4.2 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 173.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.417 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -134.42 109.08 8.52 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.228 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.478 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -90.25 87.51 6.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.4 m -80.69 119.96 23.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.625 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.67 139.79 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.035 0.445 . . . . 0.0 110.265 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.7 t -83.49 119.64 24.93 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 121.722 0.772 . . . . 0.0 110.384 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.412 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 12.7 t70 -106.47 145.64 31.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.282 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.529 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 77.9 t80 -123.32 124.75 43.67 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.644 -173.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -111.89 140.74 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.221 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.464 HD21 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -82.62 -11.08 58.65 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -172.313 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.464 ' N ' HD21 ' A' ' 50' ' ' ASN . . . -113.51 -35.82 5.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.739 0.304 . . . . 0.0 111.136 -179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -87.5 -51.64 5.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.318 0.58 . . . . 0.0 110.32 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 131.83 -150.97 19.66 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -174.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.529 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.2 mp -90.54 139.31 30.81 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -125.73 130.37 51.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.2 t -93.25 112.68 26.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 121.23 0.538 . . . . 0.0 111.003 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -93.47 113.11 25.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.597 177.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.5 88.67 6.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.254 -176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -75.79 112.79 12.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 0.0 110.171 178.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -81.93 122.9 28.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.401 -177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.617 HG12 HG12 ' A' ' 71' ' ' ILE . 58.8 mt -92.07 92.09 3.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.138 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -75.01 146.01 41.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.262 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.718 ' HB2' ' HZ2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -107.19 156.08 19.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.302 0.572 . . . . 0.0 111.631 -178.088 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.8 mt -95.08 149.87 20.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 165.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.68 -61.45 2.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.936 0.398 . . . . 0.0 111.28 -175.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.0 m -117.79 35.23 4.79 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.38 -107.25 2.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.02 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.86 -170.42 17.24 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.325 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.466 ' HB3' HG23 ' A' ' 61' ' ' ILE . 82.2 m-85 -101.82 138.43 38.81 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.623 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 52.4 p90 -143.93 135.31 25.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.214 0.53 . . . . 0.0 110.786 -178.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.617 HG12 HG12 ' A' ' 61' ' ' ILE . 63.8 mt -82.9 -34.32 11.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.495 0.665 . . . . 0.0 109.373 174.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.5 t -126.95 154.77 44.11 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.647 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.1 m -77.88 56.01 1.49 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.164 0.507 . . . . 0.0 111.311 -175.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 74' ' ' ARG . 46.9 mtp180 -139.82 -71.6 0.38 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.656 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -105.28 104.81 14.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.207 -175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -111.7 154.58 24.76 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -136.89 137.6 39.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.912 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.8 p -69.62 -12.55 61.73 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.8 p -134.97 144.37 47.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.07 0.462 . . . . 0.0 110.061 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.538 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.0 mt -66.81 -21.74 66.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.578 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -59.52 -49.58 77.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.213 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -73.69 -26.54 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.628 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.29 -61.7 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.143 177.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -66.01 -44.33 92.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.599 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.79 -39.49 58.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.068 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -84.29 -40.85 17.48 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.062 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.63 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.3 m-30 -73.0 -7.87 53.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.894 0.378 . . . . 0.0 111.946 -176.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.517 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.3 m -86.1 2.33 47.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.346 0.593 . . . . 0.0 109.846 172.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -131.66 -38.32 1.16 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.48 -176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.63 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 74.8 m-70 -133.97 111.8 10.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.542 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -74.47 -35.15 63.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -173.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.7 t0 62.19 -82.41 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.891 0.744 . . . . 0.0 111.258 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -86.15 -37.5 9.07 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.837 -176.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.57 HD11 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -69.82 147.26 50.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.98 0.419 . . . . 0.0 110.913 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 70.2 m -73.22 -14.36 61.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.003 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -136.55 131.19 33.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.028 -177.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.542 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -64.68 133.97 53.27 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 172.731 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.532 HD21 ' CG ' ' A' ' 29' ' ' PHE . 81.1 mt -56.37 107.3 0.36 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.389 -176.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.6 m -96.64 -60.86 1.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.937 -172.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.424 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.6 p30 -131.89 149.47 52.43 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.19 143.53 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 54.0 t -50.71 120.45 13.14 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.63 -174.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.0 Cg_exo -71.33 130.77 17.92 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.969 2.446 . . . . 0.0 111.396 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.322 -0.627 0 CA-C-O 121.397 0.617 . . . . 0.0 110.892 179.747 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.514 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 67.1 mm-40 . . . . . 0 N--CA 1.456 -0.152 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' HG12 ' A' ' 101' ' ' VAL . 34.7 mt-10 -58.8 -27.53 65.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.1 -174.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.613 ' HA ' HG12 ' A' ' 101' ' ' VAL . 6.6 p-90 -104.91 -32.21 8.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.073 -175.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.548 ' HB2' ' CZ3' ' A' ' 5' ' ' TRP . 58.8 t80 -90.29 111.02 22.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.796 -174.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -106.68 25.42 11.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.537 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 72.57 -150.37 44.85 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.529 -0.629 . . . . 0.0 111.529 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.792 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 15.9 pttm -107.87 71.04 0.79 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.469 0.652 . . . . 0.0 110.589 175.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 pt -73.65 149.27 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.168 172.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -77.86 167.1 22.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.231 -176.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -58.48 -44.1 89.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.82 -0.173 . . . . 0.0 110.81 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 15.9 mmm180 -53.46 -45.12 69.41 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 123.355 0.409 . . . . 0.0 110.753 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -66.17 -50.38 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.673 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.514 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 18.0 t -60.65 -51.5 69.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.356 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.585 ' HB3' HD22 ' A' ' 20' ' ' LEU . 68.9 mt-10 -77.21 -20.03 55.89 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.633 -174.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 46.4 ttp180 -61.71 -36.07 79.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.43 0.634 . . . . 0.0 109.329 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.5 mt -81.87 -44.14 17.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.034 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.567 HD23 HD22 ' A' ' 30' ' ' LEU . 78.4 mt -72.38 -28.77 63.22 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -173.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 16' ' ' GLU . 4.3 mm? -82.88 19.67 1.32 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.958 0.408 . . . . 0.0 111.365 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.437 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.7 t-20 -99.59 119.69 59.42 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.477 ' HA ' HD12 ' A' ' 54' ' ' LEU . 23.2 Cg_exo -65.02 1.47 1.89 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.584 2.856 . . . . 0.0 114.521 -172.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -76.95 -16.88 59.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.409 . . . . 0.0 110.263 175.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -94.42 124.4 55.53 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.03 171.17 14.41 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.078 2.518 . . . . 0.0 112.765 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -58.88 109.66 0.87 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.62 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.43 -2.09 6.57 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.309 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 50.5 m -74.41 111.23 9.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.737 0.303 . . . . 0.0 110.327 176.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.502 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 34.5 p90 -127.26 166.39 17.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.99 0.424 . . . . 0.0 111.454 -175.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.567 HD22 HD23 ' A' ' 19' ' ' LEU . 1.8 pt? -162.32 145.27 11.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 170.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.501 ' HB ' HD22 ' A' ' 43' ' ' LEU . 2.8 p -107.87 123.78 63.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.793 0.806 . . . . 0.0 111.107 -176.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 30.4 ptt85 -126.92 138.14 53.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.348 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.792 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 7.7 tp10 -66.55 141.53 57.82 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.761 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 50.0 m -71.75 127.68 33.34 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.059 0.456 . . . . 0.0 110.023 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.601 ' HG2' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -58.43 -26.84 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.732 -175.346 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.601 HG23 ' HG2' ' A' ' 35' ' ' GLU . 17.2 p -118.66 24.21 11.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.818 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.761 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 7.3 m -141.03 137.19 32.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.869 0.366 . . . . 0.0 110.381 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -102.66 94.72 5.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.967 0.413 . . . . 0.0 110.705 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.76 50.83 2.06 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.352 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.421 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -159.19 99.3 1.48 Allowed 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 177.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.443 ' CE1' ' HE1' ' A' ' 6' ' ' TYR . 85.5 m-85 -89.92 139.41 30.62 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.705 -169.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 91.4 m -95.93 98.4 10.37 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.882 177.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.501 HD22 ' HB ' ' A' ' 31' ' ' VAL . 2.0 tm? -73.37 92.99 1.88 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 174.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 13.9 m -88.45 99.02 11.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.132 -174.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.9 p -101.97 125.38 56.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.257 0.551 . . . . 0.0 110.519 178.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.554 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 46.8 t -82.49 130.28 35.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.819 177.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.455 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 29.7 t70 -113.98 126.99 55.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.713 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -96.72 97.39 9.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.615 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -101.95 148.56 25.2 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.451 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -82.3 -20.79 36.73 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.246 -173.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -110.95 -46.33 3.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.959 0.409 . . . . 0.0 110.98 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -85.01 -15.34 44.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.201 -177.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.21 -156.61 35.91 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.825 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 22' ' ' PRO . 49.7 mt -76.95 106.29 8.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.546 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -119.56 125.38 48.67 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.711 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.14 120.02 37.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.441 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 55.3 mttm -93.59 103.03 15.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -83.37 90.05 7.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.189 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.456 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 71.7 m-85 -76.33 129.99 37.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.59 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -93.9 109.29 21.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.382 0.611 . . . . 0.0 110.844 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.449 HG12 HG12 ' A' ' 71' ' ' ILE . 68.1 mt -84.67 112.21 21.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.654 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -103.54 164.57 11.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.396 -177.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -118.08 133.7 55.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.082 0.467 . . . . 0.0 111.241 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.502 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 83.4 mt -88.06 136.76 32.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.951 175.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.67 -20.3 65.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.877 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.3 m -128.54 42.78 3.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.323 0.582 . . . . 0.0 110.627 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -168.39 -99.07 0.13 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.228 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -174.41 -147.99 6.37 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.621 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -88.14 142.5 27.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.713 0.292 . . . . 0.0 110.243 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.502 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 18.3 p90 -149.1 134.02 18.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.268 0.556 . . . . 0.0 111.049 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.566 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 70.3 mt -87.81 -26.71 5.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 169.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.3 t -146.5 152.86 39.67 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.925 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.8 m -82.19 56.24 3.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.915 0.388 . . . . 0.0 111.652 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -130.4 -54.75 1.1 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.999 0.428 . . . . 0.0 110.786 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -122.06 106.8 11.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -99.58 146.37 26.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.656 -176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.451 ' HB3' ' HB2' ' A' ' 82' ' ' GLN . 74.3 m-85 -136.98 135.98 38.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.991 0.424 . . . . 0.0 110.794 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.1 p -78.54 -27.12 45.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.089 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.455 ' HB2' ' HG3' ' A' ' 82' ' ' GLN . 4.3 m -110.47 135.79 50.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.478 . . . . 0.0 109.74 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.563 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.7 mt -65.74 -26.56 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.13 -178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -57.42 -40.83 79.17 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.23 0.538 . . . . 0.0 110.337 174.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.455 ' HG3' ' HB2' ' A' ' 79' ' ' SER . 40.0 mt-30 -71.0 -36.56 72.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.034 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.06 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.711 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -64.23 -42.52 95.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.076 -176.679 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.15 -50.3 71.53 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -72.89 -40.48 65.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 0.0 111.013 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.579 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.4 m-30 -75.7 -1.23 23.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.194 0.521 . . . . 0.0 111.331 -178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.8 t -75.55 -32.73 60.53 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.153 0.501 . . . . 0.0 109.768 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -105.46 -42.2 5.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.615 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.579 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.6 t-80 -101.3 100.75 11.3 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.73 74.32 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.362 0.414 . . . . 0.0 110.645 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 93' ' ' GLY . 1.6 t0 63.61 -86.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.568 172.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.405 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -103.47 -27.47 6.43 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.249 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.433 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.1 mp -70.64 145.52 50.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 110.521 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 40.8 t -68.76 -24.52 64.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.305 176.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -136.09 136.56 40.25 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 145.17 47.38 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.677 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.502 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -62.94 102.73 0.38 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.403 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.6 m -87.55 -67.08 0.85 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.851 -172.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.0 p-10 -135.94 144.32 45.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.132 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.613 HG12 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -90.0 145.06 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.8 t -73.47 132.9 80.88 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.243 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -88.12 173.06 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.027 2.484 . . . . 0.0 111.694 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 15.0 p . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 121.076 0.465 . . . . 0.0 111.038 179.916 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.8 -43.69 62.44 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.558 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.4 ' HA ' HG12 ' A' ' 101' ' ' VAL . 27.1 p-90 -66.25 -43.15 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -172.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.454 ' HA ' HG13 ' A' ' 31' ' ' VAL . 38.7 t80 -85.54 96.6 9.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.008 0.433 . . . . 0.0 110.502 -178.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -76.21 -62.68 1.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.342 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 138.36 -163.41 25.73 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -177.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.61 ' HB3' ' HB2' ' A' ' 33' ' ' GLU . 8.2 pttm -83.25 62.22 6.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 111.622 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 pt -78.03 132.33 32.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 169.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.3 p -74.68 177.56 6.04 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.815 -0.175 . . . . 0.0 111.399 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -58.79 -49.8 76.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -55.66 -36.01 66.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.361 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.637 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 35.9 mt-10 -78.4 -53.42 7.28 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.887 -177.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.1 p -62.21 -46.75 87.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.914 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.76 -48.52 76.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.085 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -59.11 -27.67 65.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.407 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 82.6 mt -71.88 -39.93 69.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 0.0 110.777 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.552 HD12 HG11 ' A' ' 56' ' ' VAL . 50.2 mt -87.55 -18.09 30.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.581 -175.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.2 mm? -77.73 8.01 5.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.124 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.459 ' OD1' ' HB2' ' A' ' 23' ' ' GLU . 21.1 t-20 -91.19 113.0 56.84 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.57 ' HA ' HD11 ' A' ' 54' ' ' LEU . 60.5 Cg_endo -73.57 9.52 1.53 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.07 2.513 . . . . 0.0 113.501 -173.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.459 ' HB2' ' OD1' ' A' ' 21' ' ' ASN . 29.3 mt-10 -93.0 -10.28 36.82 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.487 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 91.3 m-20 -92.12 133.8 29.64 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.636 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 22.5 Cg_exo -65.39 160.89 40.4 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.183 2.589 . . . . 0.0 112.951 -177.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.678 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 57.3 ttp180 -72.15 120.19 17.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.754 175.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.64 6.21 25.24 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.837 -176.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 87.7 m -73.06 117.21 14.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.535 ' CZ ' HG22 ' A' ' 101' ' ' VAL . 28.2 p90 -121.19 161.5 21.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.992 0.425 . . . . 0.0 111.923 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -166.16 135.02 3.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.127 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.454 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -99.49 125.3 53.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.602 0.715 . . . . 0.0 110.704 -178.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.584 ' CG ' ' HB2' ' A' ' 42' ' ' CYS . 5.4 ptm180 -112.3 148.19 34.72 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.939 -176.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.61 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 46.7 mt-10 -67.32 120.08 13.24 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 170.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.2 t -75.08 74.82 2.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 57.1 33.53 23.47 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.357 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.519 ' OG1' ' HD3' ' A' ' 9' ' ' LYS . 3.1 m 54.5 38.18 29.23 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.808 -176.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.1 m -79.16 103.85 9.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -61.51 124.06 19.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.919 0.39 . . . . 0.0 110.124 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.45 ' O ' ' HD2' ' A' ' 62' ' ' ARG . . . 106.89 -5.49 36.78 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.118 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -143.3 108.15 4.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.178 0.513 . . . . 0.0 111.254 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -118.5 139.66 51.09 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.584 ' HB2' ' CG ' ' A' ' 32' ' ' ARG . 35.7 m -97.63 104.56 16.59 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.052 -176.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.47 97.16 7.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.55 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 43.0 t -93.63 134.72 35.64 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.113 -177.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 p -133.13 141.36 44.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.517 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 p -78.34 115.23 17.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.251 0.548 . . . . 0.0 111.074 -178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.667 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 10.5 t70 -95.37 139.18 32.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.978 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.678 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 94.1 t80 -109.86 130.13 55.56 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.075 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -124.08 143.99 50.13 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -88.98 -8.37 54.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.148 0.499 . . . . 0.0 110.84 -172.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.15 -45.15 3.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.572 177.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -86.6 -37.09 18.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.434 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 114.93 -90.5 0.53 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.779 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.57 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.3 mt -130.19 147.62 51.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.021 0.438 . . . . 0.0 111.331 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -134.68 149.54 50.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.109 174.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.552 HG11 HD12 ' A' ' 19' ' ' LEU . 39.0 t -107.75 114.8 47.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.968 0.413 . . . . 0.0 110.471 178.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.667 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 67.0 mttm -95.42 108.18 20.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.356 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -88.7 88.86 7.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.92 0.391 . . . . 0.0 110.696 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -78.09 92.17 4.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.34 126.84 30.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.62 0.724 . . . . 0.0 110.932 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.865 HG12 HG12 ' A' ' 71' ' ' ILE . 70.1 mt -96.12 127.61 48.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.909 -176.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 39' ' ' GLY . 24.2 tpt180 -99.31 140.86 32.87 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -87.34 127.56 35.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 175.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.418 ' HG ' ' H ' ' A' ' 66' ' ' SER . 21.6 tp -75.53 125.93 30.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.556 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -60.8 -29.43 69.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.354 0.597 . . . . 0.0 109.891 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.418 ' H ' ' HG ' ' A' ' 64' ' ' LEU . 4.9 m -85.05 -45.42 12.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.998 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -118.77 -109.1 2.37 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.118 -1.039 . . . . 0.0 113.154 -172.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -130.46 -101.1 0.9 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.177 -173.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -133.07 150.4 52.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.645 0.259 . . . . 0.0 110.889 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -161.23 140.2 10.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.237 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.865 HG12 HG12 ' A' ' 61' ' ' ILE . 55.9 mt -85.08 -27.99 6.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.36 0.6 . . . . 0.0 110.071 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.669 HG21 ' HG2' ' A' ' 74' ' ' ARG . 4.4 t -151.06 150.86 31.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.86 -178.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.8 m -78.32 58.89 2.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.25 0.548 . . . . 0.0 111.504 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.669 ' HG2' HG21 ' A' ' 72' ' ' THR . 15.8 ptp180 -142.47 -28.71 0.59 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.936 175.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 36.9 m -139.2 124.49 19.12 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.549 177.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -126.23 144.53 50.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.741 -174.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.51 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 75.0 m-85 -130.96 179.53 5.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.744 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.3 m -95.13 -38.74 10.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.572 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 83.4 p -122.89 166.95 14.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.999 0.428 . . . . 0.0 110.666 -177.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.617 ' O ' HG21 ' A' ' 84' ' ' VAL . 86.1 mt -77.62 -17.1 58.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.993 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -48.03 64.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.312 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -61.04 -37.75 83.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.788 176.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -54.13 -66.55 0.38 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.089 . . . . 0.0 110.709 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.617 HG21 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -61.34 -43.33 96.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -176.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.51 -42.17 77.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.988 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -82.32 -40.09 21.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.162 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.602 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.0 m-85 -74.63 -4.62 38.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.112 0.482 . . . . 0.0 111.194 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.3 t -76.91 -26.46 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.544 0.687 . . . . 0.0 109.427 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -101.88 -47.63 4.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.796 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.602 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 10.6 t-80 -113.14 109.63 19.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.795 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.62 88.85 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.339 0.399 . . . . 0.0 110.8 -177.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.414 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 37.6 t70 67.52 -78.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.089 0.868 . . . . 0.0 112.5 169.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -106.14 -37.18 2.55 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.933 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.581 HD13 ' H ' ' A' ' 94' ' ' LEU . 5.0 mp -67.14 145.81 54.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.3 0.571 . . . . 0.0 110.966 178.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.23 -19.25 59.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.079 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -127.81 125.4 39.73 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -69.75 153.12 43.81 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.442 HD23 ' CG ' ' A' ' 29' ' ' PHE . 63.4 mt -74.45 94.82 2.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.01 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.2 p -89.12 -78.2 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.725 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -111.07 145.25 38.85 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.535 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -88.37 138.06 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.4 t -55.73 124.4 56.87 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.397 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.52 133.35 23.99 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.068 1.846 . . . . 0.0 110.927 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.152 0.501 . . . . 0.0 109.796 177.608 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 110.486 -0.19 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -47.75 -53.17 16.03 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -170.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.5 p-90 -64.9 -40.9 95.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.489 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -85.48 85.51 7.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.102 0.477 . . . . 0.0 110.218 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.436 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 6.9 m-85 -67.75 -13.59 62.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.663 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 99.84 -148.03 18.4 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.983 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -95.79 50.52 1.21 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 0.0 110.801 -175.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.3 pt -75.02 147.31 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.7 p -73.85 157.32 36.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.074 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -56.9 -35.3 68.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.984 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 30.3 ttp180 -50.58 -57.18 8.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.874 174.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 27.4 mt-10 -68.61 -45.04 73.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.972 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.2 t -53.7 -58.58 6.68 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.708 -175.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.679 ' HB2' HG11 ' A' ' 56' ' ' VAL . 2.2 pt-20 -73.97 -36.02 64.54 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.456 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -56.73 -38.27 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.724 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 94.2 mt -63.65 -39.18 93.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.666 176.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.646 HD12 ' HG ' ' A' ' 44' ' ' SER . 30.4 mt -77.25 -15.75 59.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.152 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.534 HD21 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -76.71 -4.42 43.19 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 122.231 -0.293 . . . . 0.0 111.6 175.691 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -73.87 110.66 9.68 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -57.21 -14.52 15.51 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.487 2.791 . . . . 0.0 113.998 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.49 -10.67 59.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -98.89 138.49 20.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -88.09 173.15 5.0 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 123.198 2.599 . . . . 0.0 113.566 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.431 ' HD3' ' ND1' ' A' ' 96' ' ' HIS . 26.1 ttm180 -68.5 128.35 36.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.747 176.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -5.0 22.36 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.562 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.622 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 33.0 m -73.34 130.36 40.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.554 ' CG ' HD22 ' A' ' 98' ' ' LEU . 42.1 p90 -141.63 161.54 37.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.795 0.331 . . . . 0.0 111.501 -176.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.436 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.7 pt? -159.67 143.9 14.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.551 173.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -111.96 121.08 63.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.458 0.647 . . . . 0.0 110.801 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 32' ' ' ARG . 22.9 ptt85 -108.65 143.16 38.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.928 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -78.5 100.87 7.07 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.63 176.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -80.62 76.6 7.48 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -5.2 6.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.958 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -69.38 -26.57 64.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.283 0.563 . . . . 0.0 109.767 171.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.0 m -139.22 92.18 2.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.423 176.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -60.83 120.81 10.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.999 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 107.43 -6.27 36.07 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.196 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -114.49 95.61 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.323 0.582 . . . . 0.0 110.565 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.731 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.7 m-85 -87.07 148.97 25.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.904 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 59.3 m -109.39 106.12 15.78 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.665 -178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.669 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.4 tm? -86.82 90.48 8.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 174.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.646 ' HG ' HD12 ' A' ' 19' ' ' LEU . 45.3 t -81.89 129.73 34.85 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.463 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.25 143.18 41.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 120.932 0.396 . . . . 0.0 110.676 -176.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -83.44 113.82 21.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.114 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 8.2 t70 -93.92 142.58 27.22 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -126.51 118.1 24.22 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.958 0.409 . . . . 0.0 110.54 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -129.2 144.01 51.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.868 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -89.45 31.72 0.9 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.947 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -137.26 -49.57 0.61 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.304 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -99.16 -8.32 25.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.157 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.51 -134.92 12.87 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.232 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.1 mp -88.26 131.03 34.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.797 0.332 . . . . 0.0 110.59 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 30.8 m-80 -119.94 130.65 54.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 16' ' ' GLU . 84.8 t -102.32 116.43 45.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.294 0.569 . . . . 0.0 111.022 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -109.62 116.99 32.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.331 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -89.07 99.79 12.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.878 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.444 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 31.3 m-85 -79.49 155.19 28.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.21 0.529 . . . . 0.0 111.424 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 1.9 mtmt -98.25 107.84 20.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.18 -169.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.894 HG12 HG12 ' A' ' 71' ' ' ILE . 35.7 mt -99.01 75.71 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -98.28 133.64 42.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.462 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -71.96 139.42 48.66 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.888 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.25 147.92 51.54 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 169.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -45.47 -47.3 14.0 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.639 0.587 . . . . 0.0 111.375 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.0 m -139.86 48.4 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.971 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -134.06 -107.34 0.97 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.354 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -151.24 -170.66 18.43 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.786 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -91.01 141.23 29.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.695 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.481 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 53.5 p90 -145.11 143.57 30.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.648 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.894 HG12 HG12 ' A' ' 61' ' ' ILE . 54.4 mt -90.95 -21.82 6.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 122.014 0.911 . . . . 0.0 108.934 172.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.639 HG23 ' HB3' ' A' ' 92' ' ' ASP . 4.2 t -149.29 153.49 37.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.541 -1.209 . . . . 0.0 109.13 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 m -78.37 46.79 0.65 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 111.828 -174.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -131.13 -67.03 0.72 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.275 0.56 . . . . 0.0 109.592 178.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.1 m -103.95 148.96 25.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.534 177.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.481 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.7 pt20 -159.48 148.69 18.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.599 0.237 . . . . 0.0 110.92 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -137.38 149.97 47.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 111.033 -176.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.8 t -82.69 -15.12 53.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.869 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.6 m -128.32 141.58 51.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.414 ' O ' HG21 ' A' ' 84' ' ' VAL . 82.7 mt -67.6 -27.51 66.97 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.483 -173.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -66.82 -46.66 74.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.36 -30.68 71.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.654 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.533 HD12 HD12 ' A' ' 71' ' ' ILE . 3.4 tm? -54.03 -68.04 0.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.866 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -61.98 -42.64 95.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.889 -177.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.21 -47.2 72.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.082 -179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -81.0 -33.66 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.421 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.449 ' HD1' ' O ' ' A' ' 83' ' ' LEU . 26.5 m-85 -70.85 -7.35 44.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.955 0.407 . . . . 0.0 111.465 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.1 m -79.86 -16.85 54.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.661 171.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -109.4 -27.36 9.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.33 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.441 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 0.1 OUTLIER -131.42 105.23 7.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.751 -176.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.48 -41.18 66.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.792 0.33 . . . . 0.0 110.864 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.639 ' HB3' HG23 ' A' ' 72' ' ' THR . 0.8 OUTLIER 59.89 -87.43 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.797 176.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -95.12 -30.57 8.19 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.112 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.566 HD13 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -68.96 141.49 54.94 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.148 177.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.1 -17.3 62.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.628 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.431 ' ND1' ' HD3' ' A' ' 26' ' ' ARG . 80.6 m-70 -137.26 130.28 30.65 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -71.65 148.98 45.98 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.554 HD22 ' CG ' ' A' ' 29' ' ' PHE . 54.0 mt -62.39 120.09 10.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.546 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.5 m -111.43 -60.68 1.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.081 0.467 . . . . 0.0 110.933 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.622 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.9 p-10 -133.25 141.63 48.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.686 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.7 t -79.9 149.89 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.5 t -55.15 121.58 37.36 Favored Pre-proline 0 C--N 1.328 -0.349 0 O-C-N 123.645 0.591 . . . . 0.0 110.775 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -83.54 138.12 8.31 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.54 2.16 . . . . 0.0 111.515 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--N 1.323 -0.549 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.675 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -53.92 -34.61 60.07 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -166.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.6 p-90 -82.33 -35.86 27.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CE2' ' HA2' ' A' ' 8' ' ' GLY . 64.9 t80 -87.22 109.29 19.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.967 0.413 . . . . 0.0 110.721 -177.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.6 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 40.0 m-85 -96.86 19.85 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.224 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.487 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 65.55 -141.53 42.57 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.357 177.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.593 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 58.8 mtmt -107.35 87.82 2.59 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.178 0.513 . . . . 0.0 110.848 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.8 pt -103.19 155.7 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.305 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 p -84.94 174.77 9.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -59.67 -48.44 81.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.103 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -54.96 -43.13 73.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.015 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.08 -52.25 66.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.003 0.43 . . . . 0.0 110.669 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -67.35 -47.98 68.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.143 -176.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.64 -42.08 87.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.57 -175.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -55.72 -41.47 73.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.075 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.85 -44.32 55.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.336 -177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.48 HD12 ' CD2' ' A' ' 30' ' ' LEU . 79.0 mt -78.4 -26.35 46.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -172.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 20' ' ' LEU . 4.0 mm? -81.2 3.85 22.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 111.448 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.497 ' C ' ' H ' ' A' ' 23' ' ' GLU . 94.3 m-20 -73.99 138.02 76.1 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.85 30.37 0.29 Allowed 'Trans proline' 0 N--CA 1.472 0.222 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.497 ' H ' ' C ' ' A' ' 21' ' ' ASN . 33.5 mt-10 -121.37 7.47 10.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.72 -178.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.409 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 48.7 m-80 -107.54 115.06 59.94 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.569 -178.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 52.1 Cg_endo -69.04 145.8 62.52 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.462 2.108 . . . . 0.0 110.444 170.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.654 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 55.2 ttp180 -60.71 114.67 3.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.25 6.15 7.64 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.35 -172.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.785 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 94.2 m -84.27 112.47 20.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.75 0.31 . . . . 0.0 110.316 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 33.5 p90 -117.09 158.28 24.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.055 0.455 . . . . 0.0 112.114 -171.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.6 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.8 pt? -154.02 138.05 16.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 170.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.506 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.61 118.26 55.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.446 0.641 . . . . 0.0 110.869 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -111.13 149.39 30.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.825 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.593 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 44.1 tt0 -92.43 130.5 38.09 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -107.51 98.54 8.14 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -72.21 -1.99 17.15 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.378 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.8 p -64.92 -19.48 65.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.601 0.715 . . . . 0.0 109.756 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.79 159.91 22.25 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.082 176.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -80.17 71.9 6.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.124 0.488 . . . . 0.0 110.811 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.37 32.23 12.32 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.843 176.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.67 141.17 30.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.92 0.391 . . . . 0.0 110.18 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.654 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.0 m-85 -117.3 165.4 13.51 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.54 -175.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.0 m -127.66 108.58 10.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.135 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.566 ' HB2' HD12 ' A' ' 61' ' ' ILE . 2.5 tm? -89.95 90.57 8.22 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.0 m -89.11 123.29 33.25 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.456 ' CG1' ' HB2' ' A' ' 57' ' ' LYS . 14.3 p -112.22 130.31 66.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.229 177.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.45 ' HB3' ' HB ' ' A' ' 28' ' ' THR . 46.8 t -68.03 121.69 16.64 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.654 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 16.5 t70 -122.15 154.5 37.33 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.741 -170.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -135.87 95.8 3.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.502 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.51 118.18 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -75.1 60.53 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.66 0.743 . . . . 0.0 109.765 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.08 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.433 -1.258 . . . . 0.0 108.705 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -108.3 -63.7 1.3 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.81 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.74 -151.86 21.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.875 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.2 128.38 35.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.254 -178.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -151.59 177.53 10.25 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.21 119.95 59.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.664 0.269 . . . . 0.0 110.885 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.456 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 52.8 mttp -87.24 103.94 15.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -84.75 86.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.277 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.593 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 45.7 m-85 -72.41 127.77 33.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.178 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -83.39 124.84 31.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.042 0.449 . . . . 0.0 111.403 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.772 HG12 HG12 ' A' ' 71' ' ' ILE . 57.3 mt -102.25 106.33 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.676 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 62' ' ' ARG . 11.4 mmt85 -108.81 172.18 6.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.224 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 51.9 mtmt -123.9 157.74 33.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.197 0.522 . . . . 0.0 111.659 -177.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.415 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 60.1 mt -123.51 151.09 43.17 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.724 178.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.33 -64.71 0.74 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 111.145 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 65.8 m -103.1 22.46 13.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.118 0.485 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 64' ' ' LEU . . . -112.97 -97.02 2.28 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.644 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 158.79 -149.69 19.92 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.61 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -80.75 126.6 31.51 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.476 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 30.3 p90 -140.48 141.15 35.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.249 0.547 . . . . 0.0 110.271 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.772 HG12 HG12 ' A' ' 61' ' ' ILE . 23.9 mt -101.84 -6.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 122.31 1.053 . . . . 0.0 108.546 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.916 HG21 ' HA3' ' A' ' 93' ' ' GLY . 2.5 t -169.5 160.01 8.86 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.649 -173.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.2 p -74.12 0.38 14.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.757 0.313 . . . . 0.0 111.011 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -67.82 -54.73 16.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.443 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m -142.25 141.35 32.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.872 -174.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 24.7 mp0 -125.19 138.1 54.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.93 178.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -130.75 140.74 50.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 0.0 111.191 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.7 p -82.22 -8.63 59.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.332 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 24.7 m -131.23 132.73 44.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.032 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 84' ' ' VAL . 53.4 mt -64.65 -30.32 71.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.871 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.72 -46.15 84.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.329 175.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.579 ' HA ' ' OE1' ' A' ' 82' ' ' GLN . 7.9 mm-40 -77.0 -21.25 54.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -178.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 71' ' ' ILE . 3.2 tm? -62.59 -59.69 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.509 174.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.93 -42.03 88.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.945 -178.215 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.0 -22.09 62.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -91.73 -48.88 6.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.739 0.304 . . . . 0.0 110.591 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.724 ' HD2' ' HG ' ' A' ' 94' ' ' LEU . 7.0 m-85 -73.13 -5.47 39.32 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.789 -176.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.9 p -78.67 -33.0 47.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.261 0.553 . . . . 0.0 110.244 173.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -95.8 -51.65 4.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.141 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -120.89 107.27 12.49 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.323 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -62.58 -37.5 86.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.479 -176.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.41 -72.27 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.193 172.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.916 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -104.01 -22.68 8.63 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.724 ' HG ' ' HD2' ' A' ' 87' ' ' TYR . 15.4 mt -79.42 155.5 28.32 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 35.4 t -82.39 -29.18 30.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.34 0.59 . . . . 0.0 109.937 177.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -127.34 125.62 41.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.36 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -72.41 137.72 46.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.016 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.581 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 59.6 mt -61.42 100.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.791 -174.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -97.73 -53.38 3.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.697 -173.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.785 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 t30 -127.08 136.07 51.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.965 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.446 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -87.01 148.31 4.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.862 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.2 t -50.73 125.21 21.25 Favored Pre-proline 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 111.659 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -69.73 144.87 55.61 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.021 2.481 . . . . 0.0 111.749 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--N 1.318 -0.768 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.107 178.756 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 N--CA 1.452 -0.363 0 CA-C-O 120.437 0.161 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.469 ' O ' HG13 ' A' ' 101' ' ' VAL . 50.1 mt-10 -57.11 -40.77 77.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.045 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.573 ' HA ' HG13 ' A' ' 101' ' ' VAL . 4.6 p-90 -84.19 -41.62 16.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.504 ' HE1' ' HA2' ' A' ' 8' ' ' GLY . 2.6 t80 -85.41 104.36 15.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.665 -174.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -94.68 -2.66 50.82 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.504 ' HA2' ' HE1' ' A' ' 6' ' ' TYR . . . 79.14 -169.31 53.9 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.795 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.44 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 51.9 pttt -67.1 98.75 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 110.982 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.1 pt -125.66 141.58 45.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.486 172.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.2 p -73.73 152.37 40.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.258 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -60.01 -34.94 74.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.016 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.61 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 11.5 ptm180 -55.03 -41.88 71.91 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.334 0.396 . . . . 0.0 111.007 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.489 ' HG2' ' HG3' ' A' ' 13' ' ' ARG . 4.9 mm-40 -82.17 -47.61 12.3 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 33.3 t -59.17 -49.3 78.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.674 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HB2' HG13 ' A' ' 56' ' ' VAL . 3.9 pt-20 -79.9 -31.49 40.21 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.23 -174.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.61 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 24.0 ttm180 -58.13 -36.53 73.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 174.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 15' ' ' SER . 71.0 mt -60.48 -44.77 95.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.976 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.557 HD11 HG11 ' A' ' 56' ' ' VAL . 44.7 mt -74.79 -22.92 58.48 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.779 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD23 HG23 ' A' ' 56' ' ' VAL . 2.1 mm? -74.03 -7.95 54.33 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.419 175.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.425 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 94.0 m-20 -80.42 119.95 77.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' HA ' HD11 ' A' ' 54' ' ' LEU . 13.1 Cg_exo -70.35 44.61 0.47 Allowed 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.484 2.789 . . . . 0.0 113.156 -177.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -115.39 -0.46 13.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.948 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -123.09 145.42 45.98 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.152 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -87.62 172.06 5.87 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.954 2.436 . . . . 0.0 112.439 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -64.15 125.73 25.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.927 177.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.54 12.14 21.84 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.327 -0.94 . . . . 0.0 112.126 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.534 ' HB ' ' OG ' ' A' ' 46' ' ' SER . 32.6 m -81.75 116.31 21.39 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 173.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.449 ' CG ' HD21 ' A' ' 98' ' ' LEU . 38.2 p90 -121.9 168.61 11.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.769 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.71 127.96 3.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 171.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.455 HG13 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -91.34 109.61 21.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.023 0.916 . . . . 0.0 110.088 177.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 32' ' ' ARG . 18.7 ptt180 -109.49 153.98 23.3 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.587 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.61 152.48 24.8 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.725 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 3.0 p -59.8 125.66 24.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.89 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.07 -53.27 7.59 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.738 -175.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.9 p -108.88 -11.42 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.219 0.533 . . . . 0.0 110.474 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 6.0 m -91.61 158.93 16.14 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.514 -0.767 . . . . 0.0 108.958 175.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -118.41 80.28 1.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.143 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.11 54.51 0.52 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.389 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.84 88.84 1.13 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.158 0.504 . . . . 0.0 109.868 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.592 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 64.6 m-85 -64.0 141.22 58.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.077 -175.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.44 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 48.5 t -109.22 107.08 17.21 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.142 0.496 . . . . 0.0 110.576 -177.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -86.93 87.58 7.49 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t -87.06 132.2 33.88 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.6 p -126.46 140.15 49.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.874 0.368 . . . . 0.0 110.23 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.534 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 97.8 p -88.28 139.54 30.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.144 -178.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -123.87 126.87 47.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.325 0.583 . . . . 0.0 110.28 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -106.91 89.19 2.93 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.686 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.84 152.14 20.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.287 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -100.16 10.42 41.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.043 -174.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.01 -42.28 2.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.023 0.439 . . . . 0.0 110.425 176.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.54 -36.01 10.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.592 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 106.59 -156.77 16.05 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.967 -0.635 . . . . 0.0 111.57 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.476 HD11 ' HA ' ' A' ' 22' ' ' PRO . 20.7 mt -69.9 124.46 24.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.882 0.372 . . . . 0.0 110.965 177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -136.56 146.41 46.12 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.557 HG11 HD11 ' A' ' 19' ' ' LEU . 86.4 t -109.51 127.83 66.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.29 0.567 . . . . 0.0 111.217 -175.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -107.65 98.9 8.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.085 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -79.15 95.99 5.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.228 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.501 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 69.5 m-85 -84.8 148.29 26.4 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -114.31 122.05 45.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.092 0.473 . . . . 0.0 111.562 -173.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.592 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 83.5 mt -89.47 93.89 4.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.309 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -96.21 156.29 16.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -74.6 146.13 42.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.419 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.708 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 1.4 tt -53.79 -60.5 3.23 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.689 0.757 . . . . 0.0 109.884 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.5 t70 174.12 -30.29 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 113.477 -1.692 . . . . 0.0 107.582 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -125.39 -62.33 1.21 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.67 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.39 67.5 0.25 Allowed Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.951 -1.119 . . . . 0.0 113.265 -176.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -150.59 140.85 8.22 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -109.24 133.1 53.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.216 0.508 . . . . 0.0 110.098 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.708 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 53.6 p90 -148.03 149.07 31.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.482 HG12 HG12 ' A' ' 61' ' ' ILE . 58.3 mt -95.98 -20.89 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.978 0.894 . . . . 0.0 109.156 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -148.61 147.75 29.33 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.911 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m -76.12 55.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -138.49 -35.54 0.6 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -126.01 120.41 30.22 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.16 -0.216 . . . . 0.0 110.522 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -114.78 136.74 52.75 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -124.06 153.78 40.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.409 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.6 m -92.46 -19.4 22.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.091 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.2 p -131.16 145.7 52.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.951 0.405 . . . . 0.0 110.503 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.505 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.9 mt -75.89 -21.75 56.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -63.25 -43.11 98.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.168 175.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -73.24 -27.1 61.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.603 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -62.81 1.55 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.064 177.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -63.63 -42.62 96.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -176.643 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.43 92.8 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.697 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -75.88 -42.19 49.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.876 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.1 m-85 -76.25 0.64 18.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.23 0.538 . . . . 0.0 111.79 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 t -80.97 -30.28 35.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 170.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -96.06 -40.08 9.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.853 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.565 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 3.5 m-70 -110.18 113.08 25.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.291 177.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.28 82.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.764 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.9 t70 68.23 -70.74 0.12 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.532 -1.213 . . . . 0.0 112.116 168.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -131.02 -29.71 0.6 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.331 -0.462 . . . . 0.0 111.981 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.564 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -60.93 -39.84 90.95 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.84 0.829 . . . . 0.0 112.275 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.4 t 83.17 -29.65 0.09 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 112.429 -2.169 . . . . 0.0 110.162 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -97.01 124.68 41.05 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 172.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.78 141.67 44.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.289 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.449 HD21 ' CG ' ' A' ' 29' ' ' PHE . 66.8 mt -66.09 94.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.002 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.1 m -91.8 -63.81 1.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -172.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.41 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.4 p30 -133.24 163.35 29.49 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.573 HG13 ' HA ' ' A' ' 5' ' ' TRP . 1.4 t -102.26 145.64 11.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.026 0.441 . . . . 0.0 110.892 -174.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.9 t -57.74 137.29 82.87 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.43 -176.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 4.8 Cg_exo -76.33 176.54 9.93 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.527 2.818 . . . . 0.0 112.004 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.534 0.354 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.216 -178.406 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -56.27 -48.46 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.38 0.61 . . . . 0.0 110.216 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.665 ' HA ' HG12 ' A' ' 101' ' ' VAL . 8.4 p-90 -89.55 -44.3 10.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.3 -177.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.454 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 3.2 t80 -82.32 86.36 6.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.404 -175.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.54 ' CE2' ' HB ' ' A' ' 104' ' ' THR . 11.2 m-85 -69.86 -31.5 69.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.26 0.552 . . . . 0.0 110.847 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.8 -148.35 18.9 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.355 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -83.76 68.8 10.04 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.73 0.3 . . . . 0.0 111.343 -174.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.7 pt -95.47 150.01 4.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 p -82.3 166.38 19.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -71.06 -20.71 62.33 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -65.18 -44.79 87.34 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.57 -51.97 24.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.708 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 t -51.89 -68.42 0.17 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.624 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -29.29 66.61 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -61.25 -58.05 9.88 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.195 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 mp -63.96 -36.51 84.2 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.668 HD23 HD21 ' A' ' 30' ' ' LEU . 89.3 mt -70.54 -40.93 73.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.648 -177.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.33 57.96 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.324 0.583 . . . . 0.0 111.023 178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -121.08 119.25 29.83 Favored Pre-proline 0 C--N 1.321 -0.664 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 172.479 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 31.8 Cg_exo -60.28 -11.67 17.13 Favored 'Trans proline' 0 N--CA 1.473 0.321 0 C-N-CA 123.283 2.655 . . . . 0.0 113.187 -176.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -79.61 -19.15 49.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.95 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -87.92 130.31 47.06 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.046 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -84.85 166.99 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.683 2.255 . . . . 0.0 112.58 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HD2' ' CE1' ' A' ' 96' ' ' HIS . 53.1 ttp180 -57.1 128.74 38.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.447 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.66 1.3 30.71 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.902 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 70.9 m -77.66 119.88 21.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 175.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.571 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.4 p90 -134.45 174.08 10.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.909 0.385 . . . . 0.0 111.74 -173.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.668 HD21 HD23 ' A' ' 19' ' ' LEU . 2.0 pt? -171.13 147.59 2.58 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.036 171.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.413 HG13 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -101.26 118.08 47.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.443 0.64 . . . . 0.0 110.771 179.261 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -117.31 155.71 29.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.121 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -99.63 135.83 40.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.002 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.433 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 43.1 t -84.71 121.6 27.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.009 0.433 . . . . 0.0 111.097 -178.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -81.0 -18.18 47.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.48 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.59 -28.19 26.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.747 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 61.7 m -135.06 93.24 2.97 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.194 0.521 . . . . 0.0 110.627 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.433 ' HD2' ' O ' ' A' ' 34' ' ' SER . 14.3 mmmm -71.72 113.23 8.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.851 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 122.62 3.13 9.43 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.49 -175.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.97 116.67 10.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.013 0.435 . . . . 0.0 109.908 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.77 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 17.4 m-85 -92.66 161.64 14.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.655 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 60.8 m -118.67 101.32 8.02 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.969 0.414 . . . . 0.0 110.71 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.3 tm? -77.56 97.95 5.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.453 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 5.0 m -92.34 105.63 17.79 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.122 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -113.56 136.67 49.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.043 0.449 . . . . 0.0 110.892 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.6 t -86.96 127.15 35.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.481 0.658 . . . . 0.0 110.632 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.447 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 7.4 t70 -112.34 140.08 47.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.791 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.423 ' CB ' ' HB2' ' A' ' 26' ' ' ARG . 78.9 t80 -111.11 114.88 28.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.091 0.472 . . . . 0.0 110.457 -176.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -112.35 153.75 26.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.072 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -75.51 -20.23 58.86 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.997 -172.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -112.25 -49.41 2.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -80.35 -17.48 51.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -176.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.71 -146.05 28.11 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.869 -0.682 . . . . 0.0 111.891 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.33 125.12 28.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.89 0.376 . . . . 0.0 110.373 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -131.37 138.11 49.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 77.9 t -98.64 124.23 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.165 0.507 . . . . 0.0 110.91 -176.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.447 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 57.0 mttm -102.88 116.68 33.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.974 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -91.69 94.94 9.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.583 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.464 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 62.3 m-85 -77.14 128.95 35.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.347 178.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -81.84 116.65 21.61 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 -176.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.5 mt -96.44 84.09 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.41 ' HD2' ' OH ' ' A' ' 70' ' ' TYR . 43.9 ttm180 -90.12 139.04 31.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.474 . . . . 0.0 111.328 -172.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.604 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . 51.4 tttp -90.13 133.3 34.96 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.352 177.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.2 -81.36 0.13 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 177.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -170.13 -64.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.419 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 34.0 p -120.25 -23.28 6.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.714 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -64.7 -52.47 42.37 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.216 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.16 -147.64 19.32 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.344 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.604 ' CE2' ' HB2' ' A' ' 63' ' ' LYS . 84.2 m-85 -108.87 141.27 41.17 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.577 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 48.9 p90 -135.53 143.66 45.86 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.289 0.566 . . . . 0.0 111.398 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.496 HG12 HG12 ' A' ' 61' ' ' ILE . 61.3 mt -95.08 -24.78 4.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.914 171.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.3 t -133.6 149.64 51.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.2 m -78.39 59.73 2.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.932 -174.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 74' ' ' ARG . 13.8 ptt180 -169.28 -47.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.817 173.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.3 m -99.93 130.06 46.07 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.577 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.8 pt20 -149.66 153.9 37.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.749 0.309 . . . . 0.0 111.281 -174.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.466 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 93.2 m-85 -139.0 141.57 38.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.618 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.0 p -80.97 -10.8 59.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.617 0.246 . . . . 0.0 111.658 -174.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.5 m -132.29 138.48 47.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.643 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.11 -31.65 72.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.91 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -59.1 -48.64 80.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.611 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 82' ' ' GLN . 14.4 mm-40 -65.56 -40.72 93.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.647 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.559 HD13 ' N ' ' A' ' 84' ' ' VAL . 1.3 tm? -51.04 -57.98 7.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.615 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.559 ' N ' HD13 ' A' ' 83' ' ' LEU . 9.2 p -75.64 -42.44 41.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.515 -170.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.415 ' N ' HG13 ' A' ' 84' ' ' VAL . . . -59.22 -39.84 83.96 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.335 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -76.66 -42.99 39.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.854 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.544 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -74.86 -16.66 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -175.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.722 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 79.8 p -69.41 -14.57 62.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.795 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -113.2 -59.23 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.354 0.597 . . . . 0.0 109.543 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.695 ' HD2' ' HB2' ' A' ' 92' ' ' ASP . 6.5 t60 -98.84 95.33 7.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.796 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.85 -31.12 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 0.0 111.564 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.695 ' HB2' ' HD2' ' A' ' 90' ' ' HIS . 5.5 t70 53.3 -88.08 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.827 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -78.51 -43.62 12.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.408 -177.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.583 HD13 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -67.99 137.17 54.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.888 0.375 . . . . 0.0 110.81 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.72 -19.92 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.522 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.466 ' CE1' ' HD2' ' A' ' 26' ' ' ARG . 94.0 m-70 -120.03 139.51 52.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.455 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -74.76 134.21 41.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.669 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.722 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 84.9 mt -62.18 99.67 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.147 0.499 . . . . 0.0 109.783 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.7 m -84.73 -63.97 1.24 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.827 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.3 p30 -137.71 143.42 41.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.809 0.337 . . . . 0.0 110.22 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.665 HG12 ' HA ' ' A' ' 5' ' ' TRP . 1.9 t -88.3 132.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.4 t -65.4 128.35 93.72 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.58 147.09 35.39 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.491 2.127 . . . . 0.0 112.043 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.54 ' HB ' ' CE2' ' A' ' 7' ' ' PHE . 5.5 t . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 0.0 110.817 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.717 ' HA ' ' HB3' ' A' ' 6' ' ' TYR . 20.9 mt-10 . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 119.96 -0.067 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.583 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 30.2 mt-10 74.14 -47.94 0.65 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.829 0.852 . . . . 0.0 110.313 -171.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.438 ' HE3' HG13 ' A' ' 31' ' ' VAL . 1.4 p-90 -89.76 -32.99 16.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.717 ' HB3' ' HA ' ' A' ' 3' ' ' GLU . 3.1 t80 -80.09 94.31 5.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.826 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.527 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 35.4 m-85 -85.75 -13.08 49.4 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.922 0.392 . . . . 0.0 111.133 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.29 -153.51 29.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.645 176.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.494 ' CG ' ' HB2' ' A' ' 33' ' ' GLU . 30.4 mtmm -82.04 53.88 2.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.856 0.36 . . . . 0.0 111.819 -175.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.447 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 34.2 pt -77.5 140.89 16.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 173.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -70.14 163.67 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.46 ' HA ' ' NH1' ' A' ' 32' ' ' ARG . 13.4 ptp180 -57.29 -32.78 66.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.212 0.529 . . . . 0.0 110.153 176.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -60.84 -49.07 78.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.346 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -67.94 -57.35 6.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.32 -177.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.447 ' HB3' ' CD1' ' A' ' 10' ' ' ILE . 5.4 p -62.17 -52.39 64.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.864 -172.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.43 -29.21 61.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -172.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 17.0 tpt180 -69.09 -29.58 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.95 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.31 -43.21 86.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.48 ' HG ' ' HB2' ' A' ' 46' ' ' SER . 6.3 mp -74.8 -31.5 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.9 mm? -78.77 -7.68 58.03 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.098 0.406 . . . . 0.0 112.098 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.471 ' OD1' ' HD2' ' A' ' 22' ' ' PRO . 63.1 t30 -68.78 124.69 90.75 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.471 ' HD2' ' OD1' ' A' ' 21' ' ' ASN . 57.2 Cg_endo -70.46 46.68 0.61 Allowed 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 123.246 2.631 . . . . 0.0 114.553 -172.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -127.54 -4.66 5.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.102 0.477 . . . . 0.0 109.89 173.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -92.93 131.46 33.34 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.085 -176.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -86.31 162.64 9.82 Favored 'Trans proline' 0 C--O 1.239 0.559 0 C-N-CA 122.813 2.342 . . . . 0.0 111.776 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.587 ' HB2' ' HB2' ' A' ' 48' ' ' PHE . 3.2 ttm180 -60.96 117.87 6.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.18 -6.29 7.23 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.113 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.579 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 28.0 m -74.92 112.82 11.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 176.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CG ' HD22 ' A' ' 98' ' ' LEU . 34.5 p90 -125.68 161.34 27.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.987 0.422 . . . . 0.0 111.839 -174.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.527 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.2 pt? -159.99 138.2 10.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.401 171.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.438 HG13 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -98.97 114.76 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.463 0.649 . . . . 0.0 110.585 178.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.562 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 29.9 ptt180 -108.22 149.28 28.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.465 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.586 ' HG2' ' CE2' ' A' ' 41' ' ' TYR . 33.1 mt-10 -87.22 126.13 34.62 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 t -74.72 115.9 14.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.179 0.514 . . . . 0.0 110.103 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.29 -17.08 63.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.786 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.1 m -78.85 -34.76 44.79 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.281 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.7 m -136.67 113.56 10.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.957 0.408 . . . . 0.0 110.928 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -70.51 121.72 18.33 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.033 0.444 . . . . 0.0 110.638 -178.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.656 ' HA3' ' HD2' ' A' ' 63' ' ' LYS . . . 102.05 -4.86 52.66 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.016 -178.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.42 113.3 26.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.082 0.468 . . . . 0.0 110.169 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.756 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 69.1 m-85 -102.4 141.32 35.41 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.562 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 56.7 m -103.2 103.91 14.0 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 59' ' ' TYR . 2.4 tm? -79.67 86.9 5.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 172.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.2 m -84.81 114.78 22.33 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.001 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.92 136.55 50.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.938 0.399 . . . . 0.0 110.244 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.48 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 t -78.16 115.45 17.9 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.591 0.71 . . . . 0.0 109.2 172.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -110.25 136.85 48.8 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.445 -1.252 . . . . 0.0 108.982 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.587 ' HB2' ' HB2' ' A' ' 26' ' ' ARG . 56.6 t80 -82.02 126.38 31.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.985 0.421 . . . . 0.0 110.4 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -117.54 146.66 43.42 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.3 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.27 -13.9 56.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.839 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.26 -41.19 3.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.815 0.341 . . . . 0.0 110.792 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -85.91 -24.51 26.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.94 -73.14 1.99 Allowed Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -175.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.08 132.7 49.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -132.4 140.38 48.44 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 60.2 t -92.71 109.29 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.25 0.548 . . . . 0.0 110.347 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 57' ' ' LYS . 34.9 ttmt -92.26 105.21 17.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.74 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -86.6 107.93 18.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.063 -177.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.628 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 99.1 m-85 -86.11 121.79 29.21 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -83.49 109.77 17.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.615 0.721 . . . . 0.0 111.412 -177.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.756 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 72.0 mt -86.95 99.93 9.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.545 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -95.33 146.99 23.97 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.511 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HD2' ' HA3' ' A' ' 39' ' ' GLY . 0.1 OUTLIER -92.74 139.08 30.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.244 0.545 . . . . 0.0 109.914 177.623 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.433 HD12 ' NE2' ' A' ' 76' ' ' GLN . 13.9 mt -84.17 159.5 21.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.768 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -74.85 74.3 2.12 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.842 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.8 m 81.82 26.93 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.893 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.11 -38.87 1.46 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.877 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.423 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 145.39 -139.1 8.08 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 121.236 -0.506 . . . . 0.0 111.917 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -129.08 145.94 51.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -150.92 139.33 20.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.173 0.511 . . . . 0.0 111.507 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.498 HD12 ' CE2' ' A' ' 87' ' ' TYR . 33.0 mt -89.04 -30.37 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.913 0.864 . . . . 0.0 108.965 170.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -136.88 144.97 43.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.067 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.6 p -66.53 -11.04 50.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.238 -173.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -85.64 -20.7 29.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.041 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 m -135.69 112.27 10.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 0.0 111.327 -174.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.433 ' NE2' HD12 ' A' ' 64' ' ' LEU . 62.8 mt-30 -115.55 143.93 44.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.668 -176.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.421 ' HZ ' ' CD2' ' A' ' 86' ' ' TYR . 94.7 m-85 -126.97 162.73 25.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.116 177.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 t -86.72 -29.98 22.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.852 -0.158 . . . . 0.0 111.305 -177.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 88.3 p -143.81 167.77 21.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.619 0.247 . . . . 0.0 110.703 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 83' ' ' LEU . 2.6 mm? -65.47 -26.4 67.92 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.8 0.333 . . . . 0.0 111.161 177.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.32 -43.16 91.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.429 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -70.1 -31.0 68.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.534 HD11 ' CD2' ' A' ' 87' ' ' TYR . 2.2 tm? -55.78 -68.23 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.699 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -41.67 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -173.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.98 -27.89 47.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.039 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.421 ' CD2' ' HZ ' ' A' ' 77' ' ' PHE . 85.5 t80 -84.24 -52.39 6.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.85 178.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.534 ' CD2' HD11 ' A' ' 83' ' ' LEU . 22.5 m-85 -65.37 -15.91 63.06 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.629 -175.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.646 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.9 t -66.23 -32.02 73.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.007 0.432 . . . . 0.0 110.441 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.467 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 73.3 mmtt -113.59 -41.01 3.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.849 -176.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 13.1 m-70 -120.99 110.17 15.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -72.41 -39.25 68.07 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.98 -176.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 65.36 -75.52 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.628 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.79 -34.8 4.52 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.569 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -58.42 142.09 49.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.307 0.575 . . . . 0.0 111.238 176.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 20.7 m -74.45 -24.99 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.875 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -137.38 147.95 45.87 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.664 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.467 ' HD2' ' O ' ' A' ' 89' ' ' LYS . 40.3 mtm180 -84.71 135.77 34.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.037 -177.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 81.7 mt -55.8 110.35 0.71 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.905 0.384 . . . . 0.0 110.537 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -94.92 -63.25 1.19 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.386 -174.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -134.74 146.93 49.87 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.5 t -83.37 153.39 3.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.014 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.3 t -59.28 136.52 88.56 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.668 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.7 Cg_exo -65.68 146.11 83.2 Favored 'Trans proline' 0 C--N 1.347 0.447 0 C-N-CA 123.012 2.474 . . . . 0.0 111.553 175.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.667 -177.486 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 120.43 0.157 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -57.27 -52.67 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.04 0.448 . . . . 0.0 110.434 174.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -71.61 -35.97 70.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.946 -177.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.434 ' HA ' HG13 ' A' ' 31' ' ' VAL . 39.3 t80 -89.41 101.06 13.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.889 0.376 . . . . 0.0 110.793 -176.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.462 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 15.5 m-85 -84.37 -33.62 23.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.369 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 124.83 -166.8 17.36 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.321 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.817 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 14.1 pttp -89.5 59.28 4.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.877 0.846 . . . . 0.0 111.229 -178.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.1 pt -76.42 149.21 6.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.671 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 47.2 p -82.35 167.75 18.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -61.84 -38.55 88.62 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.621 -177.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -41.29 68.6 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.232 0.539 . . . . 0.0 110.694 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -78.49 -47.59 17.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.491 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -61.35 -48.43 81.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.477 -176.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.62 -32.37 69.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.021 -176.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -60.05 -30.57 69.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.95 -40.39 28.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.095 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.453 HD22 HD23 ' A' ' 30' ' ' LEU . 74.5 mt -81.96 -23.11 36.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 20' ' ' LEU . 3.8 mm? -85.22 42.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.338 0.589 . . . . 0.0 111.261 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -104.62 128.78 26.19 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 169.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.551 ' HA ' HD12 ' A' ' 54' ' ' LEU . 11.9 Cg_endo -55.23 -22.15 31.43 Favored 'Trans proline' 0 N--CA 1.473 0.306 0 C-N-CA 123.495 2.797 . . . . 0.0 114.549 -170.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -98.74 23.75 8.39 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.852 -177.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -78.17 115.46 51.03 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 120.853 0.359 . . . . 0.0 110.045 173.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.434 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 21.5 Cg_exo -65.35 154.32 74.16 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.907 2.405 . . . . 0.0 111.956 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -66.16 109.1 2.49 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.484 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.91 22.55 5.62 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.544 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 61.5 m -83.73 124.38 30.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 175.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.458 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 29.5 p90 -133.29 161.62 34.0 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.462 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.1 pt? -160.92 138.23 9.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.788 170.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.453 ' HB ' HD21 ' A' ' 43' ' ' LEU . 2.1 p -103.47 118.91 51.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.666 0.746 . . . . 0.0 110.855 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 19.0 ptt85 -112.67 148.81 33.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.443 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.817 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 35.0 tt0 -83.93 134.99 34.64 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 37' ' ' THR . 38.0 m -73.75 130.06 39.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.434 0.635 . . . . 0.0 111.565 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -79.36 -18.7 51.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.488 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.2 p -119.89 9.22 11.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.515 ' O ' ' HB2' ' A' ' 34' ' ' SER . 78.9 m -153.79 124.63 7.25 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.758 0.313 . . . . 0.0 110.653 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -103.64 138.87 39.7 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.789 0.328 . . . . 0.0 110.131 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.31 9.38 56.88 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -175.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -150.44 120.75 7.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.938 0.399 . . . . 0.0 110.392 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.488 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 57.0 m-85 -101.3 165.01 11.5 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.414 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 32.4 t -117.47 111.64 19.56 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.744 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.453 HD21 ' HB ' ' A' ' 31' ' ' VAL . 2.3 tm? -90.71 87.03 6.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.4 m -78.28 122.09 25.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.869 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 p -118.67 138.43 49.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.96 0.41 . . . . 0.0 110.331 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -94.19 128.96 40.93 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.604 0.716 . . . . 0.0 110.063 179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -112.16 133.23 54.42 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.519 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -105.97 112.52 25.61 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.457 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -118.59 147.74 43.4 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.469 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -79.58 -13.36 59.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.719 -174.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.21 -44.0 2.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 111.246 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -81.4 -20.59 40.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.064 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 85.94 -133.11 11.55 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.98 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 22' ' ' PRO . 95.0 mt -96.84 109.65 22.31 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.146 0.498 . . . . 0.0 110.284 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -105.87 116.52 32.08 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.009 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 82.7 t -91.62 107.8 19.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.151 0.5 . . . . 0.0 109.937 178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -95.31 114.52 26.31 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.216 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -89.56 87.11 6.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.537 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.433 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 76.8 m-85 -76.46 157.38 32.25 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -123.04 120.6 33.81 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.22 0.533 . . . . 0.0 111.51 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.584 HG12 HG12 ' A' ' 71' ' ' ILE . 52.8 mt -89.8 88.24 2.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.782 176.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -93.71 154.46 17.78 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.504 -174.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 21.4 pttp -109.8 142.6 40.83 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.105 0.479 . . . . 0.0 110.214 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.479 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 45.2 mt -78.97 175.01 10.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.801 177.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -62.06 -46.27 89.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.705 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.9 t -153.28 58.71 0.77 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -140.59 -33.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.839 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 121.73 -158.97 16.41 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.248 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.67 147.84 25.54 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.448 0.299 . . . . 0.0 110.389 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.479 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 44.9 p90 -156.04 143.23 19.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.602 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.676 HG23 HD12 ' A' ' 94' ' ' LEU . 62.0 mt -83.86 -29.78 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.578 0.704 . . . . 0.0 109.134 173.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.414 HG21 ' HA3' ' A' ' 93' ' ' GLY . 11.5 t -146.12 161.06 41.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.472 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.8 p -78.07 59.34 2.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.986 0.422 . . . . 0.0 111.304 -177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -132.04 -78.98 0.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.37 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.8 m -100.67 122.42 43.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.335 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -104.17 147.11 27.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.262 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.587 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 95.9 m-85 -132.02 142.25 49.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 121.343 0.592 . . . . 0.0 111.391 -178.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -72.67 -21.3 61.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.517 -177.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.1 p -141.34 172.66 12.37 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.82 0.343 . . . . 0.0 111.231 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 85.7 mt -79.52 -28.19 41.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.712 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -64.9 -43.7 92.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -60.76 -36.76 79.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.393 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.65 HD22 HG13 ' A' ' 71' ' ' ILE . 3.2 tm? -55.75 -67.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.564 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -41.47 92.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -175.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.94 -34.92 66.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.79 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.976 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.753 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 34.9 m-85 -70.93 -7.75 48.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.373 -176.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.585 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.9 t -71.31 -23.04 61.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.188 0.518 . . . . 0.0 110.08 173.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -116.05 -45.75 2.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.177 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.753 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 24.9 m-70 -111.06 116.67 31.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.049 177.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.58 -24.51 64.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.514 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 35.3 t70 62.63 -81.8 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.612 0.765 . . . . 0.0 112.072 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.414 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -101.53 -33.26 4.85 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.743 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.676 HD12 HG23 ' A' ' 71' ' ' ILE . 4.0 mp -71.0 171.05 11.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.052 0.453 . . . . 0.0 110.329 175.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . 0.559 ' HG ' ' CE1' ' A' ' 96' ' ' HIS . 5.5 p -114.3 12.74 17.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.455 0.645 . . . . 0.0 109.514 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.559 ' CE1' ' HG ' ' A' ' 95' ' ' CYS . 79.2 m80 -128.26 118.15 22.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.001 -0.999 . . . . 0.0 109.756 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -75.66 133.6 40.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 176.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 64.8 mt -66.49 88.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.4 m -88.49 -57.5 2.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.439 -171.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.5 p-10 -130.64 145.2 51.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.824 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.88 158.4 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.842 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.3 t -56.4 133.64 76.48 Favored Pre-proline 0 C--N 1.327 -0.396 0 O-C-N 123.498 0.499 . . . . 0.0 111.292 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.34 154.56 56.17 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.697 2.265 . . . . 0.0 112.019 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.513 179.98 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.04 -50.11 28.96 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 123.62 0.575 . . . . 0.0 112.101 -172.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.481 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 4.6 p-90 -77.94 -31.23 50.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.358 -174.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.481 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 63.4 t80 -91.11 106.33 18.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.789 0.328 . . . . 0.0 111.082 -174.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.521 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 43.8 m-85 -94.55 15.32 18.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.511 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.472 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 81.79 -131.09 10.14 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.552 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -122.54 115.73 22.68 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.671 0.748 . . . . 0.0 110.033 176.59 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.541 ' HB ' ' HB2' ' A' ' 14' ' ' GLU . 35.1 pt -131.85 154.08 39.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.045 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.7 p -96.9 179.85 4.81 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.549 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 12' ' ' ARG . 8.2 ptm180 -54.51 -32.04 57.3 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.191 0.307 . . . . 0.0 111.232 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 59.9 ttp180 -59.72 -51.79 68.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.902 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.541 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 11.8 mp0 -72.68 -45.81 57.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.934 0.397 . . . . 0.0 110.458 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.9 t -59.73 -66.87 0.45 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.959 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.06 -23.1 65.2 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -177.495 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -62.66 -42.44 99.62 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.2 0.524 . . . . 0.0 109.963 178.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.8 mt -80.89 -39.57 26.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.878 -177.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.546 HD13 HD21 ' A' ' 30' ' ' LEU . 62.4 mt -79.45 -35.22 40.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.267 -172.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 3.9 mm? -83.21 14.18 3.68 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.177 0.513 . . . . 0.0 110.524 177.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -92.82 107.19 22.61 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 172.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -72.63 49.17 1.44 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.327 2.685 . . . . 0.0 114.416 -169.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -119.63 4.72 11.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.345 0.593 . . . . 0.0 109.839 172.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -104.59 144.25 28.33 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.339 -178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -84.61 168.7 11.11 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 123.156 2.571 . . . . 0.0 112.054 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -63.96 129.23 39.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.949 0.404 . . . . 0.0 110.834 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.19 3.67 31.24 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.213 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 85.4 m -72.33 109.15 5.86 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.902 -0.406 . . . . 0.0 109.902 175.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.427 ' CG ' HD21 ' A' ' 98' ' ' LEU . 32.5 p90 -126.83 161.31 28.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 111.621 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.546 HD21 HD13 ' A' ' 19' ' ' LEU . 2.1 pt? -160.59 143.64 13.26 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG11 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -107.78 122.13 61.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.69 0.757 . . . . 0.0 110.905 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 16.1 ptt180 -117.19 142.07 47.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.228 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -81.92 121.5 26.57 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.733 ' HB2' HG21 ' A' ' 37' ' ' THR . 4.2 m -77.54 113.15 15.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.686 0.279 . . . . 0.0 110.304 -177.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -70.54 -3.83 19.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.862 0.363 . . . . 0.0 111.477 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.7 t -95.63 9.19 41.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.139 0.495 . . . . 0.0 110.7 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.897 HG22 ' HB1' ' A' ' 40' ' ' ALA . 11.1 t -150.14 169.78 20.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.734 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -123.67 30.08 6.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.558 0.694 . . . . 0.0 110.736 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.432 ' HA2' ' HE2' ' A' ' 63' ' ' LYS . . . 171.2 44.18 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.801 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.897 ' HB1' HG22 ' A' ' 37' ' ' THR . . . -152.34 101.44 2.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.146 0.498 . . . . 0.0 110.614 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.693 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 41.9 m-85 -90.71 149.37 22.08 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.82 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.0 m -108.92 106.48 16.48 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.694 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.444 ' HB2' HD12 ' A' ' 61' ' ' ILE . 1.6 tm? -84.41 88.2 7.27 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.416 ' HG ' ' CE1' ' A' ' 58' ' ' HIS . 15.1 m -85.5 108.75 18.07 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.357 -176.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.2 p -107.89 124.56 64.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.336 0.589 . . . . 0.0 110.653 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.6 t -79.39 129.81 34.82 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.138 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.34 115.65 13.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.136 -176.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -83.45 83.97 7.69 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 170.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -71.21 110.31 5.78 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.03 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -74.19 73.65 1.77 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.203 0.525 . . . . 0.0 110.552 -172.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.82 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.938 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -121.93 -34.57 3.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.709 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.77 -148.45 16.86 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.648 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -75.51 114.93 14.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.0 111.67 -177.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -126.13 117.39 23.04 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 91.9 t -88.93 106.2 16.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -84.23 102.26 12.5 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.12 -175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.416 ' CE1' ' HG ' ' A' ' 44' ' ' SER . 15.2 m-70 -80.98 93.89 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.914 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.651 ' HB3' HG21 ' A' ' 71' ' ' ILE . 57.4 m-85 -77.13 124.62 28.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.119 0.485 . . . . 0.0 110.025 177.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -88.23 110.9 21.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.07 -170.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.693 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 54.4 mt -91.45 94.25 4.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.793 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -92.01 157.07 16.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.745 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HE2' ' HA2' ' A' ' 39' ' ' GLY . 43.5 mtmt -97.88 147.23 24.65 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.624 0.726 . . . . 0.0 112.168 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.458 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 87.1 mt -115.84 130.55 56.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.332 -1.303 . . . . 0.0 109.212 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -72.54 -22.6 60.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.938 0.399 . . . . 0.0 110.482 -178.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 p -113.89 30.97 6.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.789 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.41 -94.08 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.325 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.458 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 173.52 -134.01 2.77 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.828 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -99.26 137.02 38.36 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' O ' ' HA ' ' A' ' 61' ' ' ILE . 25.8 p90 -144.11 140.46 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.167 0.508 . . . . 0.0 110.839 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.668 HG12 HG12 ' A' ' 61' ' ' ILE . 59.2 mt -87.0 -35.37 8.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.781 174.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.2 t -143.63 159.75 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.452 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -75.88 57.28 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.507 0.67 . . . . 0.0 110.739 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -130.74 -64.45 0.83 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.773 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.2 m -134.47 123.01 23.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.698 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.29 144.06 44.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.679 0.276 . . . . 0.0 110.831 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -127.62 147.3 50.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 p -83.35 10.5 8.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.126 0.489 . . . . 0.0 111.125 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.0 m -148.65 135.23 19.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.773 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.623 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.9 mt -63.25 -35.2 79.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.647 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -61.73 -46.06 91.26 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.713 0.292 . . . . 0.0 110.819 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -61.34 -38.63 87.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.821 178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.413 HD12 HD12 ' A' ' 71' ' ' ILE . 3.2 tm? -58.42 -64.14 1.03 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.994 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.9 m -63.51 -45.31 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.61 -33.64 68.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -78.12 -46.3 21.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.832 0.349 . . . . 0.0 110.462 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.603 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-85 -73.11 -7.33 50.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.442 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.6 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 28.0 t -74.67 -15.92 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.281 0.562 . . . . 0.0 109.851 174.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -120.58 -51.42 2.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.626 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.603 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.0 t-80 -103.4 107.06 17.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.76 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 66.92 -65.48 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.071 0.548 . . . . 0.0 112.458 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -125.6 -30.93 0.86 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.952 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.565 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.3 mp -64.92 148.28 51.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.281 0.562 . . . . 0.0 111.183 178.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 62.2 m -78.4 -6.97 56.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.933 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -152.71 144.33 23.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -67.62 145.62 54.67 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.91 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.6 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 87.5 mt -64.79 95.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.7 m -90.34 -60.5 1.91 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.754 -171.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.8 p-10 -131.66 141.19 49.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -176.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -80.87 149.95 4.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.439 ' HA ' HG22 ' A' ' 28' ' ' THR . 51.7 t -56.7 117.95 20.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -75.18 147.37 33.17 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.912 2.408 . . . . 0.0 110.712 173.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 C--N 1.321 -0.642 0 CA-C-O 121.167 0.508 . . . . 0.0 110.793 -178.603 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -98.89 -54.99 2.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.273 0.558 . . . . 0.0 110.063 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' HE3' ' CG1' ' A' ' 31' ' ' VAL . 5.3 p-90 -68.6 -28.73 67.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.854 -176.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -80.89 125.93 30.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.199 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.573 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 16.9 m-85 -118.62 34.6 5.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.043 0.449 . . . . 0.0 111.9 -178.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.5 -141.52 35.43 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.934 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.66 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 33.0 mtmm -117.98 48.34 1.41 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.74 0.305 . . . . 0.0 111.22 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 pt -67.81 151.32 10.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.56 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.3 p -80.62 172.46 13.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.203 -178.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -59.77 -48.22 82.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 110.283 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.8 -47.5 77.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.137 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.2 -41.13 97.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.931 0.396 . . . . 0.0 110.826 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 22.7 t -62.95 -48.15 80.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.283 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.661 ' HB3' HD23 ' A' ' 20' ' ' LEU . 61.3 mt-10 -69.74 -27.91 65.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.357 -178.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -60.74 -30.19 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.224 0.535 . . . . 0.0 110.374 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.14 -28.49 18.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.469 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.538 HD21 HD23 ' A' ' 30' ' ' LEU . 83.3 mt -93.83 -34.23 13.24 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.661 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.1 mm? -79.17 49.43 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.481 0.658 . . . . 0.0 111.179 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.402 ' C ' ' H ' ' A' ' 23' ' ' GLU . 92.3 m-20 -125.23 112.81 26.18 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.426 ' HA ' HD22 ' A' ' 54' ' ' LEU . 57.8 Cg_endo -71.82 41.76 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.998 2.465 . . . . 0.0 113.326 -175.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 21' ' ' ASN . 36.7 mt-10 -128.45 9.44 6.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.931 177.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -110.5 149.88 40.87 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.681 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -82.92 157.68 15.62 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.81 2.34 . . . . 0.0 112.158 176.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -62.94 140.07 58.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 120.898 0.38 . . . . 0.0 110.396 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.97 2.43 59.43 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.39 -0.909 . . . . 0.0 111.667 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.704 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 65.3 m -73.2 110.79 7.76 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.576 ' CG ' HD22 ' A' ' 98' ' ' LEU . 27.0 p90 -127.35 158.07 38.24 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.124 0.487 . . . . 0.0 111.586 -172.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.573 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.6 pt? -152.24 132.86 13.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.504 170.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.439 ' CG1' ' HE3' ' A' ' 5' ' ' TRP . 2.6 p -103.1 114.27 42.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.964 -177.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.498 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 24.4 ptt85 -109.1 144.16 37.5 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.07 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.66 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 36.6 tt0 -83.36 138.21 33.62 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.131 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 45.4 t -88.01 138.15 31.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.336 0.589 . . . . 0.0 111.686 -175.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -93.34 -15.85 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.307 175.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.3 p -98.96 -5.56 30.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -173.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 40' ' ' ALA . 17.6 m -148.69 131.63 16.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.714 0.292 . . . . 0.0 110.734 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.98 121.33 26.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.47 -178.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.72 31.23 36.87 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.143 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -130.45 128.84 42.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.92 0.39 . . . . 0.0 110.241 178.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -119.86 147.67 44.41 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.81 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.498 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 35.4 m -105.15 94.75 5.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.529 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.695 ' HB2' HD13 ' A' ' 61' ' ' ILE . 1.7 tm? -77.93 88.86 4.1 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 174.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.6 m -87.27 114.84 24.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.488 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -120.25 141.2 41.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.086 0.469 . . . . 0.0 111.124 -176.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.0 t -84.15 129.36 34.9 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.801 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 25.5 t0 -123.61 61.12 1.07 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.435 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.71 111.44 3.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.381 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.511 ' OD2' ' HG2' ' A' ' 52' ' ' LYS . 9.9 t70 -114.97 144.12 44.09 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.448 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -75.06 -12.44 60.32 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.927 -170.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -104.27 -44.22 5.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.856 0.36 . . . . 0.0 111.304 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.814 ' HG3' HD22 ' A' ' 55' ' ' ASN . 6.6 ptpp? -101.19 -9.0 21.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.19 0.519 . . . . 0.0 111.575 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.49 -148.71 19.73 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.544 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 22' ' ' PRO . 86.0 mt -80.73 114.6 19.73 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.41 0.284 . . . . 0.0 111.129 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.814 HD22 ' HG3' ' A' ' 52' ' ' LYS . 13.4 m-80 -115.13 124.05 50.52 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.626 HG21 HD21 ' A' ' 20' ' ' LEU . 79.8 t -111.59 114.66 47.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.211 0.529 . . . . 0.0 110.373 177.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -97.81 105.59 17.76 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.106 -176.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -81.61 83.9 6.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -67.34 127.07 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.29 0.567 . . . . 0.0 111.864 -176.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -82.04 96.1 7.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.485 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.695 HD13 ' HB2' ' A' ' 43' ' ' LEU . 58.6 mt -74.92 97.72 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 175.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -91.4 137.8 32.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.383 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -91.83 151.57 20.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.253 0.549 . . . . 0.0 109.983 174.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.43 157.51 20.46 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 168.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -51.32 -44.08 61.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.3 m -67.51 -26.84 66.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 123.02 42.74 0.39 Allowed Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.37 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.61 108.66 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.917 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -84.97 130.13 34.68 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -143.12 143.25 31.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.394 0.616 . . . . 0.0 111.306 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.67 HG12 HG12 ' A' ' 61' ' ' ILE . 70.8 mt -92.4 -39.44 11.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.47 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.8 t -114.78 147.89 39.15 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.813 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.0 p -67.81 -7.24 26.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 74' ' ' ARG . 63.7 mtt180 -83.74 -57.61 3.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.904 0.383 . . . . 0.0 110.812 178.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.405 HG21 ' CD2' ' A' ' 86' ' ' TYR . 1.3 m -101.68 104.82 15.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.812 -171.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -113.96 133.87 55.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.668 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.492 ' CD2' ' HA ' ' A' ' 83' ' ' LEU . 83.8 m-85 -124.49 146.6 48.87 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.2 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.4 t -88.23 -2.39 58.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 45.5 m -144.03 137.35 27.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.054 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.525 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.9 mt -65.38 -23.46 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -56.52 -47.72 78.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.297 0.57 . . . . 0.0 110.204 174.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -73.36 -27.2 61.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.638 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.492 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 3.4 tm? -59.12 -64.74 0.83 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.262 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.25 -44.31 97.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.755 -176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.76 -42.27 62.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.032 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.405 ' CD2' HG21 ' A' ' 75' ' ' THR . 91.2 t80 -78.14 -43.05 29.91 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.63 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -69.84 -12.34 61.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.665 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.47 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 50.0 m -72.63 -22.36 60.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.274 0.559 . . . . 0.0 110.096 173.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -104.59 -44.47 4.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.643 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.63 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 31.6 m-70 -125.5 114.81 19.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.623 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -76.39 -40.71 50.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.69 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.47 ' HB3' HG21 ' A' ' 72' ' ' THR . 12.2 t70 65.42 -76.32 0.04 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.732 177.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.03 -40.42 8.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.209 -0.52 . . . . 0.0 112.156 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.623 ' HB2' ' HB3' ' A' ' 91' ' ' ALA . 4.5 mp -67.4 150.15 49.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.061 0.457 . . . . 0.0 110.47 178.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 32.6 t -72.68 -18.03 61.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.558 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -149.79 139.68 21.89 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.593 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 32.7 ptt85 -73.58 158.18 35.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.093 0.473 . . . . 0.0 111.515 -176.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.576 HD22 ' CG ' ' A' ' 29' ' ' PHE . 59.6 mt -66.52 101.3 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.062 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.8 m -97.65 -41.5 8.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.636 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.704 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.0 t30 -141.65 132.74 26.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.026 0.441 . . . . 0.0 110.511 -175.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.4 t -81.06 139.39 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.447 ' HA ' HG21 ' A' ' 28' ' ' THR . 51.0 t -53.65 118.76 15.82 Favored Pre-proline 0 C--N 1.33 -0.251 0 O-C-N 123.507 0.504 . . . . 0.0 111.135 -176.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.73 151.96 46.98 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.469 2.113 . . . . 0.0 111.558 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 C--N 1.322 -0.625 0 CA-C-O 120.943 0.401 . . . . 0.0 110.07 176.739 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.43 -28.51 13.18 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.538 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.736 ' HA ' HG12 ' A' ' 101' ' ' VAL . 15.3 p-90 -82.03 -28.72 32.35 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.435 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -99.59 110.15 22.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.118 0.485 . . . . 0.0 110.612 -174.668 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -98.94 -0.9 41.27 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.0 -156.6 23.75 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.193 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -86.47 61.35 6.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.396 0.617 . . . . 0.0 111.547 -177.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.53 HD11 HD11 ' A' ' 30' ' ' LEU . 46.3 pt -74.47 138.0 21.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 174.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.6 p -72.94 159.73 33.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' A' ' 15' ' ' SER . 10.2 ptm180 -67.2 -23.54 65.75 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.883 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 23.2 tpt180 -61.89 -39.0 90.43 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.96 -35.42 64.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.791 176.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.496 ' HB3' ' HA ' ' A' ' 12' ' ' ARG . 29.0 t -60.52 -67.21 0.42 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.981 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -54.48 -38.85 66.9 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.739 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -57.15 -39.46 75.27 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -177.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.0 mt -86.6 -34.89 19.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.6 mt -81.07 -17.96 48.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.215 -174.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.54 14.08 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.591 0.234 . . . . 0.0 111.567 177.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.563 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 21.5 t30 -67.77 120.14 71.45 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -57.35 -20.78 41.35 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.043 2.495 . . . . 0.0 113.302 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -98.47 21.1 11.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.858 0.361 . . . . 0.0 111.472 -178.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.563 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 94.5 m-20 -89.82 118.21 68.76 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 170.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.91 144.3 64.02 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.152 1.901 . . . . 0.0 111.489 175.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.445 ' HB2' ' HB3' ' A' ' 48' ' ' PHE . 41.0 ttp180 -56.41 110.68 0.81 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.109 177.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.16 -0.6 7.08 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.644 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 37.1 m -77.36 129.05 35.31 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.564 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 28.6 p90 -139.39 171.25 14.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.151 0.5 . . . . 0.0 111.959 -173.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.53 HD11 HD11 ' A' ' 10' ' ' ILE . 3.4 pp -158.17 149.2 20.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.513 166.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.507 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.07 120.65 59.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.746 0.784 . . . . 0.0 110.814 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.643 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.8 145.95 37.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.279 -179.324 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -89.63 131.89 35.4 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.319 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.8 t -104.64 107.71 18.79 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -75.66 -3.04 32.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.965 0.412 . . . . 0.0 111.315 -173.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -42.64 87.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.33 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.445 ' HB ' ' HB1' ' A' ' 40' ' ' ALA . 29.6 m -121.19 127.55 51.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.356 -177.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -79.12 74.26 5.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.419 0.628 . . . . 0.0 110.366 -177.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.515 ' HA2' ' HE3' ' A' ' 63' ' ' LYS . . . 139.52 27.08 0.25 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.202 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.445 ' HB1' ' HB ' ' A' ' 37' ' ' THR . . . -138.86 97.65 3.37 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.174 0.511 . . . . 0.0 110.457 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.751 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.7 m-85 -90.7 169.81 10.67 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.643 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -128.55 110.56 12.38 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.549 ' HB2' HD13 ' A' ' 61' ' ' ILE . 2.6 tm? -89.68 93.52 9.5 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 175.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 38.0 m -84.49 105.42 15.29 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -104.4 135.03 44.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 t -75.89 125.59 29.39 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.534 0.683 . . . . 0.0 110.467 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -105.94 133.04 51.29 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.173 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 53' ' ' GLY . 55.7 t80 -141.73 114.6 8.57 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.761 0.791 . . . . 0.0 112.679 -171.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.876 ' HB3' ' HA3' ' A' ' 53' ' ' GLY . 0.6 OUTLIER -84.75 142.31 29.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.862 165.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -58.91 -12.73 4.84 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -166.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -129.02 -54.32 1.2 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -117.85 -11.18 10.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -166.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.876 ' HA3' ' HB3' ' A' ' 49' ' ' ASP . . . -102.42 58.26 0.59 Allowed Glycine 0 C--O 1.225 -0.411 0 C-N-CA 119.807 -1.187 . . . . 0.0 115.394 -163.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.419 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 12.5 mt -90.47 131.4 36.24 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.932 0.866 . . . . 0.0 110.538 171.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.557 ' N ' HD21 ' A' ' 55' ' ' ASN . 0.1 OUTLIER -175.85 166.89 3.1 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.626 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.8 t -102.92 125.24 57.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 120.773 0.321 . . . . 0.0 110.176 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -99.22 101.44 12.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -82.19 104.06 12.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.334 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -91.37 136.68 32.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.872 173.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -93.51 127.49 39.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.182 0.515 . . . . 0.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.751 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.6 mt -93.5 101.41 12.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.259 177.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.2 142.79 27.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.831 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.515 ' HE3' ' HA2' ' A' ' 39' ' ' GLY . 26.0 ttpp -108.75 128.57 54.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.614 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.8 mt -75.81 150.69 37.65 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.876 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -53.06 -54.7 31.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.053 0.454 . . . . 0.0 111.406 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -129.87 45.69 2.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.208 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 -107.21 0.74 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.202 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -152.83 -151.11 5.59 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.778 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -110.15 141.82 42.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.73 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 46.4 p90 -147.38 137.59 23.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.161 0.505 . . . . 0.0 110.923 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.467 HG12 HG12 ' A' ' 61' ' ' ILE . 75.2 mt -84.65 -52.56 12.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -103.81 146.8 28.1 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.545 171.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.5 t -81.74 47.91 1.14 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.238 0.542 . . . . 0.0 111.02 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 73.3 mtp180 -135.37 -57.73 0.79 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.918 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 31.0 m -105.23 116.79 32.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.73 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.4 pt20 -133.73 148.51 51.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.259 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.519 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 96.1 m-85 -131.79 143.38 50.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.161 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.5 m -75.56 -5.1 43.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.5 m -140.88 144.12 35.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.248 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.513 ' O ' HG23 ' A' ' 84' ' ' VAL . 69.6 mt -68.26 -27.27 66.19 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.112 -176.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -54.28 48.9 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -59.38 -33.33 71.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.309 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.51 -65.24 0.69 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.47 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.83 -44.92 96.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -175.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.32 -43.65 83.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.033 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -76.26 -36.18 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.416 -177.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.559 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 8.4 m-85 -79.88 0.18 32.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.92 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.583 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 50.2 m -67.64 -29.74 69.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.48 0.657 . . . . 0.0 109.47 173.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -115.72 -43.22 3.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.984 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.559 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 73.1 m80 -94.97 90.88 6.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.308 -178.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.692 ' HB1' ' HG3' ' A' ' 97' ' ' ARG . . . -66.12 -35.57 80.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.884 0.373 . . . . 0.0 110.195 177.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.86 -83.99 0.02 OUTLIER 'General case' 0 C--O 1.235 0.292 0 CA-C-N 114.788 -1.097 . . . . 0.0 111.908 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.24 -42.75 4.84 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.993 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.558 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -60.81 153.02 25.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.056 0.455 . . . . 0.0 110.964 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . 0.437 ' HG ' ' CD2' ' A' ' 96' ' ' HIS . 25.3 p -88.13 -10.07 51.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.161 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.437 ' CD2' ' HG ' ' A' ' 95' ' ' CYS . 82.3 m-70 -121.65 149.99 42.39 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.661 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.692 ' HG3' ' HB1' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -105.84 137.6 43.45 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.093 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.8 mt -68.62 87.17 0.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.175 0.512 . . . . 0.0 110.706 -177.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.7 m -80.41 -48.58 12.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.548 -173.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -155.24 152.71 29.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.791 0.329 . . . . 0.0 110.26 -178.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.736 HG12 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -91.52 140.35 16.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.996 -176.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.94 125.49 92.01 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.275 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.99 159.27 44.95 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.796 2.331 . . . . 0.0 111.683 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.913 -175.397 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 CA--C 1.523 -0.066 0 CA-C-O 121.4 0.619 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -54.9 -43.98 73.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.613 -168.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -76.56 -38.49 54.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -86.34 107.21 17.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 0.0 111.053 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.474 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 27.1 m-85 -97.88 14.41 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.361 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.02 -143.42 28.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.763 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -111.17 51.6 0.77 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.138 0.494 . . . . 0.0 111.26 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 pt -61.73 147.17 11.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.057 175.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.7 p -87.82 -175.96 5.33 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.587 -177.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -39.51 94.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.97 0.414 . . . . 0.0 110.7 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -55.07 -48.22 73.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.321 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.66 -55.31 15.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.552 -176.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.9 p -61.36 -56.76 16.74 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -172.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HB3' HD23 ' A' ' 20' ' ' LEU . 1.6 mp0 -66.62 -29.25 69.24 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -176.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -66.46 -25.26 66.64 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.935 -0.478 . . . . 0.0 110.481 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.7 mt -85.52 -38.75 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.97 0.414 . . . . 0.0 110.794 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.412 HD11 HD21 ' A' ' 30' ' ' LEU . 81.7 mt -82.06 -28.67 32.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.162 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.417 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.0 mm? -78.89 52.35 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.997 0.427 . . . . 0.0 111.442 178.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.432 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 51.3 m-80 -136.33 132.02 18.78 Favored Pre-proline 0 C--N 1.32 -0.713 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 15.3 Cg_exo -69.41 7.67 0.85 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.303 2.669 . . . . 0.0 112.4 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 21' ' ' ASN . 25.5 mt-10 -94.36 -1.0 54.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.053 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -97.21 129.18 32.73 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.09 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.525 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 15.2 Cg_exo -66.24 138.68 52.21 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.279 1.986 . . . . 0.0 111.087 173.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -61.79 101.31 0.19 Allowed 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.85 -3.12 3.42 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.505 -171.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.546 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 89.1 m -69.77 117.47 11.41 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 122.452 0.301 . . . . 0.0 110.457 175.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.539 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 36.5 p90 -123.98 164.68 18.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.067 0.46 . . . . 0.0 111.821 -175.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.474 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.9 pt? -164.22 146.02 8.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.709 173.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -112.94 120.18 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.52 0.676 . . . . 0.0 111.347 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.499 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 27.4 ptt180 -107.17 150.98 26.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.169 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -92.45 142.59 27.26 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 175.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.2 t -72.36 123.54 23.26 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -76.88 -15.25 59.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.909 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -101.09 -21.78 14.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.906 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 23.8 m -130.23 121.0 25.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.059 0.457 . . . . 0.0 111.479 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -85.25 115.4 23.0 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 1.02 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 115.1 11.74 10.61 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.603 -175.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.03 129.16 23.68 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.006 0.431 . . . . 0.0 110.493 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.756 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 88.4 m-85 -120.25 179.67 4.22 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.499 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 61.5 m -139.09 100.11 3.94 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.688 0.28 . . . . 0.0 110.332 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.8 tm? -82.94 95.96 8.15 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 174.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.5 t -93.19 143.09 26.59 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.91 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.8 p -136.05 133.01 50.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.155 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -80.14 126.61 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.592 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.52 147.59 50.7 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.792 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -133.34 113.66 12.84 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.335 0.588 . . . . 0.0 110.698 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.517 ' HB3' ' HD3' ' A' ' 52' ' ' LYS . 11.6 m-20 -105.8 137.99 42.75 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.84 173.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -71.4 -9.13 57.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.353 -173.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.17 -21.59 9.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.517 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -103.2 -23.8 13.6 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.858 0.361 . . . . 0.0 111.315 -177.106 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.05 23.09 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.69 114.79 17.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.928 0.394 . . . . 0.0 110.489 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -108.72 120.18 41.73 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.058 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 74.2 t -92.04 107.09 18.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.035 0.445 . . . . 0.0 109.971 175.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -91.51 100.38 13.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.944 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -85.56 88.99 7.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.491 . . . . 0.0 110.471 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.569 ' HB3' HG22 ' A' ' 71' ' ' ILE . 87.7 m-85 -77.79 88.04 4.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.542 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.495 ' HA ' ' HA ' ' A' ' 42' ' ' CYS . 22.2 pttp -62.75 132.26 51.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.231 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.756 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 70.5 mt -98.8 125.9 52.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.499 -176.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -109.27 137.52 47.03 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.333 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 1.02 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 23.1 mtpp -84.71 145.21 28.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.502 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.99 -6.69 48.92 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 168.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.414 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 10.2 t70 73.93 -55.57 0.66 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.649 178.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.0 m -105.94 24.98 11.49 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.949 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.62 -107.82 0.46 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.291 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -129.42 -157.04 9.04 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.205 -174.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -119.38 141.75 48.79 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -146.07 136.05 23.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.507 0.67 . . . . 0.0 111.6 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.722 HG12 HG12 ' A' ' 61' ' ' ILE . 69.9 mt -82.77 -48.3 17.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.13 173.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -118.53 150.78 39.05 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.904 176.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -81.1 51.53 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -135.96 -77.53 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.326 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.0 m -94.47 104.47 16.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.209 0.528 . . . . 0.0 110.01 178.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -110.7 150.21 29.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 -173.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -129.51 141.55 50.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.977 0.417 . . . . 0.0 110.916 -178.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.497 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 15.8 m -83.1 20.46 1.23 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.686 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.9 t -167.57 161.45 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.537 ' O ' HG23 ' A' ' 84' ' ' VAL . 58.5 mt -83.48 -34.38 25.39 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -171.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -43.62 80.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -57.39 -36.33 71.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.414 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -61.81 -62.48 1.77 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.65 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -63.61 -43.21 98.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.157 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.04 -45.13 79.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.75 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -75.24 -42.61 54.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.776 0.322 . . . . 0.0 110.994 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.619 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-30 -70.16 -4.15 20.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.509 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -29.39 65.76 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.332 0.587 . . . . 0.0 109.725 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -107.11 -48.02 3.56 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.704 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.619 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.9 m-70 -107.24 102.41 11.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.276 -179.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -68.42 -37.08 79.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.814 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 t70 68.39 -71.63 0.11 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.69 175.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.44 -39.23 3.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.127 -0.558 . . . . 0.0 111.86 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.57 HD11 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -63.04 146.54 53.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.876 0.369 . . . . 0.0 110.68 176.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.1 -15.6 56.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.335 177.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -133.42 135.31 44.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.579 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -85.1 152.41 23.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.034 0.445 . . . . 0.0 110.63 -179.179 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 56.6 mt -67.56 101.83 1.06 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.959 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.2 m -91.58 -62.84 1.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.546 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.2 p-10 -133.67 147.92 51.45 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -177.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.528 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.3 t -91.13 151.75 3.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.251 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 52.4 t -57.97 124.71 70.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.016 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 9.2 Cg_endo -89.76 178.14 2.44 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 123.39 2.726 . . . . 0.0 112.277 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.4 p . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.434 178.021 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.484 ' HB2' ' CB ' ' A' ' 6' ' ' TYR . 5.9 mm-40 . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.428 ' O ' HG12 ' A' ' 101' ' ' VAL . 28.5 mm-40 -55.0 -29.69 57.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.504 -172.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.407 ' HE3' HG11 ' A' ' 31' ' ' VAL . 9.0 p-90 -96.14 -33.94 11.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.484 ' CB ' ' HB2' ' A' ' 3' ' ' GLU . 9.8 t80 -79.54 93.64 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.796 -174.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.437 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.9 m-85 -80.74 -21.48 41.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.115 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.57 -158.05 27.11 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.596 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HG2' ' HB2' ' A' ' 33' ' ' GLU . 66.5 mttm -79.26 55.14 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.6 pt -78.18 153.69 5.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -83.96 154.14 23.5 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.785 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 13' ' ' ARG . 17.8 ptt85 -56.94 -40.07 75.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -170.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.423 ' N ' ' HG3' ' A' ' 12' ' ' ARG . 22.3 tpp180 -60.54 -35.01 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.63 0.253 . . . . 0.0 110.72 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 46.7 mt-10 -65.56 -40.25 92.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.229 177.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.6 m -66.58 -47.6 72.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.269 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.24 -40.17 96.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.639 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -57.64 -31.99 66.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.277 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 92.0 mt -84.86 -39.66 18.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.397 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.485 HD22 HD23 ' A' ' 30' ' ' LEU . 60.2 mt -80.77 -27.93 36.58 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.461 HD11 HD12 ' A' ' 54' ' ' LEU . 3.8 mm? -79.83 50.71 1.21 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.669 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -135.99 139.23 29.75 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.49 14.41 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.202 2.601 . . . . 0.0 112.843 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -97.32 -1.74 43.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.419 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 41.2 m-80 -110.34 112.76 56.84 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.358 -177.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 30.2 Cg_endo -65.36 157.0 60.27 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.53 2.153 . . . . 0.0 111.432 175.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -63.13 99.76 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.98 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 138.32 -0.66 2.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.072 -174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 59.7 m -72.38 124.68 25.64 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.585 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 31.7 p90 -132.15 166.07 22.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.14 0.495 . . . . 0.0 112.127 -173.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.485 HD23 HD22 ' A' ' 19' ' ' LEU . 1.8 pt? -160.3 143.51 13.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.713 170.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.469 ' HB ' HD23 ' A' ' 43' ' ' LEU . 3.1 p -107.12 115.44 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.636 0.731 . . . . 0.0 111.171 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.505 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 1.6 ptm180 -104.05 157.4 17.14 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.812 177.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.548 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 49.5 mt-10 -96.31 137.68 35.03 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 174.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -82.81 118.11 23.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.604 0.716 . . . . 0.0 109.398 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -40.18 96.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.996 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -84.98 -65.87 0.96 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.323 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.2 m -77.68 92.09 4.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.439 0.637 . . . . 0.0 110.567 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -82.32 151.98 26.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.756 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.442 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 82.67 14.43 75.78 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -172.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -149.49 113.83 5.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.968 0.413 . . . . 0.0 110.173 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.796 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 22.9 m-85 -92.62 175.41 6.83 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 43.8 t -135.31 102.93 5.32 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.206 -178.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.469 HD23 ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -85.62 91.34 8.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 m -86.65 121.23 28.88 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.08 -179.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.9 p -118.72 138.38 49.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.132 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -78.88 120.34 23.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.795 0.807 . . . . 0.0 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.598 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 9.5 t70 -107.26 76.06 1.06 Allowed 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.024 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 54' ' ' LEU . 74.3 t80 -77.54 95.15 4.45 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.54 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -95.92 154.95 16.96 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.211 -177.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -84.15 -16.29 44.08 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.355 -173.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.99 -43.74 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.75 0.31 . . . . 0.0 111.165 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -82.69 -37.26 25.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.051 0.453 . . . . 0.0 110.818 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 108.61 -162.85 12.82 Favored Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 -176.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.576 ' HA ' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -79.61 104.99 10.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.676 0.751 . . . . 0.0 111.759 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 10.1 m-80 -102.14 157.18 17.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.322 178.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.0 t -112.79 115.56 50.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.143 0.497 . . . . 0.0 110.259 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -93.52 109.15 20.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.601 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -89.31 98.7 11.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.855 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -92.58 103.45 15.85 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -69.69 125.71 27.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.327 0.584 . . . . 0.0 111.048 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.796 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -91.97 93.9 4.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.38 155.18 23.64 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.023 -173.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 59.8 mtpt -105.43 146.63 29.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.792 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.419 ' O ' ' HB3' ' A' ' 65' ' ' ASP . 98.4 mt -78.8 -74.22 0.29 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.206 173.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 6.2 p-10 173.2 -44.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.543 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.7 p -136.86 -29.89 0.9 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.899 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.48 -44.76 97.58 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.766 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.42 -147.36 18.57 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.889 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -109.86 152.16 26.12 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.05 0.54 . . . . 0.0 109.684 -177.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -150.52 135.75 17.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.192 0.52 . . . . 0.0 111.305 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.625 HG12 HG12 ' A' ' 61' ' ' ILE . 66.5 mt -92.0 -24.02 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 122.198 0.999 . . . . 0.0 108.469 171.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.4 t -148.71 145.66 27.77 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.348 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -64.97 -21.4 66.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -169.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -86.48 -0.87 56.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.9 m -147.04 108.81 4.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.33 133.47 55.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.197 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -123.02 132.9 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.774 0.321 . . . . 0.0 110.622 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 m -79.45 3.4 18.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.6 m -150.68 132.63 15.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.559 ' O ' HG21 ' A' ' 84' ' ' VAL . 30.7 mt -66.19 -25.32 66.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.682 -177.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -62.7 -46.8 86.45 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -66.67 -32.07 73.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.55 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.571 HD11 HD12 ' A' ' 71' ' ' ILE . 3.4 tm? -57.56 -65.95 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.302 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.559 HG21 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -62.54 -43.63 98.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.98 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.175 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -76.74 -43.56 36.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.729 0.3 . . . . 0.0 111.053 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.663 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 25.4 m-85 -70.73 -9.09 56.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.608 -177.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.641 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 70.6 m -67.45 -28.39 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.212 0.53 . . . . 0.0 110.013 173.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.49 -48.53 3.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.663 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 56.2 m170 -110.27 116.47 31.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.29 178.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.47 -38.01 65.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.814 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 61.02 -78.98 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.092 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.86 -40.59 5.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.739 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.579 HD11 ' H ' ' A' ' 94' ' ' LEU . 5.0 mp -67.17 149.36 50.59 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.956 0.408 . . . . 0.0 110.081 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 59.1 m -76.67 -17.93 58.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.537 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -133.04 134.02 43.83 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -68.95 151.27 46.75 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 74.2 mt -67.79 84.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.202 0.525 . . . . 0.0 109.848 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.8 m -73.82 -58.76 3.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.234 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.462 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -139.75 146.84 40.02 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.069 0.461 . . . . 0.0 110.095 -177.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.509 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.5 t -89.31 149.4 4.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.8 -179.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -65.68 119.13 57.9 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.155 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.5 135.69 26.95 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.588 2.192 . . . . 0.0 112.465 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.0 p . . . . . 0 C--N 1.322 -0.61 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.762 176.917 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.79 85.54 7.28 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 175.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -69.24 108.36 3.62 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.787 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 30.42 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.788 1.635 . . . . 0.0 113.333 -173.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 5.1 p-90 -81.38 -34.78 31.47 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.997 -173.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.55 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 1.0 OUTLIER -86.45 88.45 7.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.083 0.468 . . . . 0.0 110.462 -174.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -75.98 -30.37 58.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.759 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.3 -157.72 14.76 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.737 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -82.49 57.52 3.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.484 0.659 . . . . 0.0 111.466 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.02 134.49 26.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -73.83 165.06 25.79 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.854 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -54.94 -49.57 71.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.743 -0.208 . . . . 0.0 111.238 -177.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -61.5 -41.32 97.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.609 -175.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -61.57 -42.4 98.8 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.355 0.598 . . . . 0.0 110.019 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.2 t -67.83 -41.21 83.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.085 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -61.53 -42.19 98.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.503 0.192 . . . . 0.0 110.972 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -57.98 -35.37 71.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.334 . . . . 0.0 110.908 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -78.13 -40.94 36.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.764 HD23 HD21 ' A' ' 30' ' ' LEU . 97.2 mt -76.95 -39.21 51.44 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -174.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.01 38.16 0.27 Allowed 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.457 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 23.7 m-80 -89.51 118.75 69.34 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.23 -18.07 17.18 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.359 2.706 . . . . 0.0 113.461 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -86.58 -2.26 58.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.533 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.457 ' ND2' ' HB2' ' A' ' 21' ' ' ASN . 95.9 m-20 -84.89 131.89 47.69 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.813 0.339 . . . . 0.0 110.421 177.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -82.64 156.42 16.09 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.705 2.27 . . . . 0.0 111.919 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.47 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 33.8 ttp180 -61.64 123.32 17.57 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.096 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.51 -5.0 10.91 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.436 -175.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 87.0 m -66.06 114.38 5.17 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.908 0.416 . . . . 0.0 110.123 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.521 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 43.2 p90 -128.55 166.7 18.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.755 0.312 . . . . 0.0 111.625 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.764 HD21 HD23 ' A' ' 19' ' ' LEU . 1.7 pt? -169.11 152.03 4.94 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 6' ' ' TYR . 1.3 p -110.54 119.28 59.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.443 0.64 . . . . 0.0 111.006 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.491 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 10.5 ptp85 -102.04 151.32 22.29 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.495 178.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -93.85 117.22 29.81 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -76.71 121.4 23.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 0.0 110.946 -174.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -91.98 -16.12 26.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.059 174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 t -88.73 -13.88 38.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.627 0.727 . . . . 0.0 109.582 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.6 m -139.35 93.17 2.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.658 171.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HB3' ' HZ3' ' A' ' 38' ' ' LYS . 1.8 mmmp? -69.96 141.87 52.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.651 -173.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.54 64.96 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.872 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.35 144.2 33.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.027 0.442 . . . . 0.0 110.341 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.572 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.0 m-85 -113.52 172.78 6.76 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.2 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.491 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 39.9 t -140.01 112.16 7.64 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.786 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.534 ' HB2' HD13 ' A' ' 61' ' ' ILE . 2.4 tm? -85.33 102.34 13.3 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 173.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 t -99.51 124.67 44.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.653 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -118.22 138.15 49.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.125 0.488 . . . . 0.0 110.58 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.9 m -91.05 105.84 18.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.437 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.47 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 3.7 m-20 -88.8 169.11 11.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.189 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -143.68 123.92 13.78 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.448 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -128.13 135.51 49.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -80.94 51.84 1.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.773 0.797 . . . . 0.0 109.772 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.51 -26.29 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.282 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -114.11 -20.34 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.342 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.13 -158.32 34.5 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.9 mp -74.32 114.01 12.19 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.84 127.52 49.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.346 0.593 . . . . 0.0 110.57 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 98.6 t -86.06 121.37 37.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.056 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.567 ' HB2' ' HZ2' ' A' ' 57' ' ' LYS . 3.4 ttmp? -102.05 110.41 22.37 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.726 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -89.08 99.76 12.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.702 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.11 142.93 27.22 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 13.0 mmmm -99.42 131.58 45.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.925 -172.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.572 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -98.5 98.82 7.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.706 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.457 HH11 ' HD2' ' A' ' 62' ' ' ARG . 54.6 mtt180 -83.21 150.82 25.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.926 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -109.79 128.27 55.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.288 0.566 . . . . 0.0 111.646 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.46 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 79.3 mt -90.37 136.53 33.0 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.73 -12.25 59.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.201 0.524 . . . . 0.0 110.851 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -135.43 42.15 2.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.38 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -159.05 -70.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.804 -178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.46 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 156.87 -123.65 1.33 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.276 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -119.91 144.49 47.4 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -175.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.423 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 15.3 p90 -156.94 136.61 12.34 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.531 . . . . 0.0 110.849 175.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.426 ' HA ' ' O ' ' A' ' 60' ' ' LYS . 58.8 mt -87.11 -30.21 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.094 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.429 ' C ' ' H ' ' A' ' 74' ' ' ARG . 8.9 t -140.74 157.21 45.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.447 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.4 m -74.69 42.53 0.17 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.252 0.548 . . . . 0.0 111.575 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.429 ' H ' ' C ' ' A' ' 72' ' ' THR . 30.5 mtp85 -125.95 -71.9 0.68 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.546 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.405 HG23 ' CE2' ' A' ' 86' ' ' TYR . 0.2 OUTLIER -96.11 125.6 40.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.959 179.085 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -130.93 131.14 44.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.913 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.599 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 92.9 m-85 -130.9 146.54 52.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.705 -175.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -83.42 3.12 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 41.2 m -152.06 156.74 40.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.536 ' O ' HG23 ' A' ' 84' ' ' VAL . 92.6 mt -66.38 -43.49 85.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.835 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -58.76 -47.34 85.04 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.841 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.467 ' HB3' ' HB3' ' A' ' 77' ' ' PHE . 20.4 tt0 -56.32 -35.1 67.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.115 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.44 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 7.9 tt -69.56 -60.49 2.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.886 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -60.84 -41.54 89.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -53.84 -45.79 71.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.748 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.405 ' CE2' HG23 ' A' ' 75' ' ' THR . 66.6 t80 -71.57 -46.08 60.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.858 0.361 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.599 ' HE1' ' HE2' ' A' ' 77' ' ' PHE . 2.5 m-85 -66.55 -11.93 55.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.22 -177.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.531 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.2 t -72.34 -27.42 62.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 110.344 176.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -104.53 -48.64 3.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.351 0.596 . . . . 0.0 110.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.465 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.7 t-160 -113.54 108.23 16.89 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.93 87.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.505 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.3 t70 67.75 -67.03 0.19 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.758 174.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -110.06 -32.26 2.88 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.212 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.578 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.2 mp -69.46 155.79 39.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.063 0.458 . . . . 0.0 111.07 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 m -78.55 -19.43 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.462 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -142.43 135.04 28.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.235 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -74.37 144.85 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.006 0.432 . . . . 0.0 111.174 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 69.6 mt -56.83 109.76 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.63 -176.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.1 m -98.71 -60.09 1.61 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 -173.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.7 p-10 -134.63 147.22 50.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.749 -176.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.413 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.1 t -88.37 146.58 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -55.39 122.07 41.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 O-C-N 123.718 0.636 . . . . 0.0 111.307 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -78.02 136.14 14.51 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.29 1.994 . . . . 0.0 112.086 177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 t -110.61 171.26 7.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 10.8 t -140.42 33.09 1.87 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.249 0.547 . . . . 0.0 109.709 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.624 ' HE3' ' HA ' ' A' ' 106' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.486 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 121.787 0.803 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.9 53.39 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.394 -1.275 . . . . 0.0 107.788 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.91 140.29 58.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.823 -166.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -52.64 -39.45 61.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.506 -1.224 . . . . 0.0 113.423 -168.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -66.08 -33.35 75.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.415 ' HA ' HG13 ' A' ' 31' ' ' VAL . 79.2 t80 -83.47 99.93 10.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.776 0.322 . . . . 0.0 110.378 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.454 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.6 m-85 -83.68 -24.07 31.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.201 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.13 -166.14 13.35 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.86 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.644 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 44.6 pttt -86.69 78.81 9.05 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.632 0.73 . . . . 0.0 111.324 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 pt -97.79 149.81 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -76.53 171.01 15.33 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.83 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -58.18 -47.81 82.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.109 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 45.5 mtp180 -56.66 -41.6 77.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.166 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.88 -52.86 46.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.063 0.458 . . . . 0.0 110.531 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 6.9 m -62.14 -55.1 32.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.553 -174.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.405 ' HG2' HG21 ' A' ' 56' ' ' VAL . 34.4 mt-10 -71.88 -22.51 61.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.094 -173.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.546 ' HG3' ' HE2' ' A' ' 106' ' ' LYS . 8.4 tpt180 -76.33 -23.23 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.059 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -88.85 -21.57 23.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.829 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.607 HD23 HD22 ' A' ' 30' ' ' LEU . 80.2 mt -93.88 -31.87 14.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.822 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 20' ' ' LEU . 3.5 mm? -77.66 53.35 1.09 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.145 0.498 . . . . 0.0 111.298 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.507 ' HB2' ' OD1' ' A' ' 24' ' ' ASN . 87.3 m-20 -113.63 128.97 25.12 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 173.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.91 -12.2 21.3 Favored 'Trans proline' 0 N--CA 1.471 0.191 0 C-N-CA 122.843 2.362 . . . . 0.0 112.866 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -83.72 -33.63 25.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.796 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 21' ' ' ASN . 4.3 m-20 -54.12 116.89 11.37 Favored Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.549 -178.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.96 151.44 24.1 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.487 2.124 . . . . 0.0 112.061 177.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -55.49 116.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.408 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.53 -2.89 9.49 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.804 -0.713 . . . . 0.0 111.958 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.511 ' HB ' ' HB2' ' A' ' 46' ' ' SER . 46.3 m -73.05 121.86 20.83 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 175.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.538 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -134.9 159.11 42.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.036 0.446 . . . . 0.0 111.873 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.607 HD22 HD23 ' A' ' 19' ' ' LEU . 2.3 pt? -155.59 137.35 14.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.97 170.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.415 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.4 p -99.8 114.48 38.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.717 0.77 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 ptt85 -115.11 160.17 19.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.575 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.644 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.9 tt0 -99.78 139.75 34.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.491 ' HB3' HG22 ' A' ' 36' ' ' THR . 45.6 m -100.11 115.77 30.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.292 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -64.32 -17.26 63.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.009 -174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.491 HG22 ' HB3' ' A' ' 34' ' ' SER . 10.6 t -61.47 -22.17 64.83 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.713 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.0 m -151.49 102.08 2.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.808 ' HB2' ' HZ1' ' A' ' 38' ' ' LYS . 4.4 ttmp? -55.61 113.36 1.42 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.095 -177.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.97 -2.2 48.01 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.612 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -100.01 112.96 25.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.77 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 75.5 m-85 -96.43 161.88 13.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.075 -177.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.53 117.7 19.12 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.83 176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.648 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -82.38 85.6 6.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.401 ' O ' HD21 ' A' ' 30' ' ' LEU . 19.2 m -74.46 111.9 10.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.907 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.8 p -107.86 136.86 41.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.006 0.431 . . . . 0.0 110.742 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.511 ' HB2' ' HB ' ' A' ' 28' ' ' THR . 15.4 m -81.04 107.55 13.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.875 176.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -102.86 147.87 26.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.849 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.547 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 88.1 t80 -133.46 113.7 12.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.404 0.621 . . . . 0.0 110.534 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -96.68 139.47 32.7 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.667 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -81.48 49.83 1.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.281 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -171.32 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.537 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -105.2 5.81 32.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.667 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.02 -146.62 38.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.138 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.547 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.1 mp -96.29 147.0 24.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 0.0 110.891 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -143.67 154.56 43.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.399 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.405 HG21 ' HG2' ' A' ' 16' ' ' GLU . 84.1 t -108.15 120.01 58.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 120.976 0.417 . . . . 0.0 111.078 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -102.14 114.42 28.54 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.688 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -89.71 86.04 6.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.052 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.402 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 49.9 m-85 -69.0 129.24 39.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.838 0.351 . . . . 0.0 110.805 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 38.9 mmtm -75.03 122.24 23.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.505 -172.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 59.2 mt -107.29 87.24 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -110.74 163.17 14.03 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.496 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 36.3 mtmm -99.29 150.17 22.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.34 0.59 . . . . 0.0 111.73 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 68.7 mt -95.56 177.11 5.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.79 -1.095 . . . . 0.0 109.993 172.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -51.23 -58.16 6.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.437 0.46 . . . . 0.0 110.897 175.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 p -142.21 14.43 2.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.045 0.45 . . . . 0.0 111.547 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -84.71 -32.96 20.33 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.348 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.494 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 110.19 -144.61 17.01 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.829 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -93.92 143.26 26.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.507 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 13.1 p90 -154.86 139.63 17.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.933 0.397 . . . . 0.0 110.74 177.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.636 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 62.1 mt -97.12 -26.27 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 122.071 0.939 . . . . 0.0 108.505 171.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.474 HG22 ' HB3' ' A' ' 92' ' ' ASP . 1.3 t -136.37 144.04 44.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.069 -1.423 . . . . 0.0 108.678 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.3 m -68.82 -15.74 63.59 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -170.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HD2' ' OD1' ' A' ' 92' ' ' ASP . 61.5 mtt85 -71.32 -58.74 3.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 0.0 110.874 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.411 HG21 ' CE1' ' A' ' 86' ' ' TYR . 25.1 m -102.54 124.08 47.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.28 -175.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -124.93 137.29 54.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.829 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -137.53 135.75 37.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.669 0.271 . . . . 0.0 110.784 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.0 m -88.38 14.18 10.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.152 0.501 . . . . 0.0 110.702 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 29.0 m -143.65 132.05 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.784 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 84' ' ' VAL . 88.6 mt -66.93 -25.29 66.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.06 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -48.11 79.09 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.95 -32.8 74.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.524 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -54.67 -64.8 0.72 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.534 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -66.64 -40.8 87.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.089 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.55 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.924 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.411 ' CE1' HG21 ' A' ' 75' ' ' THR . 60.9 t80 -93.04 -47.33 7.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.696 0.284 . . . . 0.0 111.04 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.636 ' HE2' ' HB ' ' A' ' 71' ' ' ILE . 2.8 m-85 -68.75 -9.0 48.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.035 -175.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.652 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 5.8 p -72.69 -33.37 66.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.374 0.607 . . . . 0.0 110.33 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -100.86 -39.83 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.678 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 34.3 m170 -115.47 111.99 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.93 -33.81 64.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.993 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.492 ' OD1' ' HD2' ' A' ' 74' ' ' ARG . 9.8 t70 62.9 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.566 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -101.23 -32.0 5.4 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 121.237 -0.506 . . . . 0.0 112.088 -178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.564 HD13 ' H ' ' A' ' 94' ' ' LEU . 5.0 mp -68.6 152.51 45.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 74.1 m -90.75 13.13 17.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 109.851 174.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -140.18 134.39 31.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.653 -175.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -97.78 120.22 37.78 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.652 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 63.9 mt -52.25 106.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 111.201 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.2 m -98.8 -58.47 1.94 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.269 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 p30 -135.45 151.95 50.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -90.23 146.41 6.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 120.773 0.32 . . . . 0.0 110.191 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 49.8 t -52.56 133.93 44.84 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.821 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.9 135.73 42.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.796 2.331 . . . . 0.0 111.011 173.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -13.91 61.16 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -177.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 62.7 m -136.26 135.2 38.8 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.23 0.538 . . . . 0.0 111.618 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.546 ' HE2' ' HG3' ' A' ' 17' ' ' ARG . 22.6 pttp . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.656 175.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 121.28 0.562 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.12 76.28 1.32 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.196 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -82.09 -172.53 4.0 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.327 -172.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.436 ' O ' HG13 ' A' ' 101' ' ' VAL . 15.6 mm-40 -50.11 -51.91 39.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.604 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.529 ' CD1' HG23 ' A' ' 84' ' ' VAL . 1.2 p-90 -84.61 -23.71 29.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.163 -173.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.4 ' HA ' HG12 ' A' ' 31' ' ' VAL . 23.0 t80 -85.18 106.73 16.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.552 -173.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.6 -21.75 26.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.878 0.37 . . . . 0.0 111.098 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.08 -163.57 12.35 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.48 -0.867 . . . . 0.0 113.489 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -83.84 56.63 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.817 0.447 . . . . 0.0 111.219 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.529 ' O ' ' HD2' ' A' ' 32' ' ' ARG . 39.5 pt -90.41 139.21 17.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.084 0.468 . . . . 0.0 110.092 177.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -78.76 177.56 8.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.755 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -55.26 -46.82 76.09 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -177.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -56.12 -48.5 76.08 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.787 -177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -59.9 -36.12 76.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.241 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -64.38 -52.83 56.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.82 0.343 . . . . 0.0 110.449 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -70.11 -29.28 66.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.648 -179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -57.75 -40.01 78.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.019 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.2 mt -88.04 -31.15 19.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.873 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.53 HD22 HD23 ' A' ' 30' ' ' LEU . 59.9 mt -82.39 -30.65 30.08 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -172.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.449 ' HA ' HD12 ' A' ' 20' ' ' LEU . 1.9 mm? -77.52 26.65 0.17 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.241 0.473 . . . . 0.0 112.216 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 19' ' ' LEU . 93.0 m-20 -99.17 120.03 59.21 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.21 -3.63 4.25 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 C-N-CA 123.42 2.747 . . . . 0.0 114.034 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -77.57 -12.68 59.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.467 . . . . 0.0 110.463 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -83.83 124.65 74.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.998 -178.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.89 151.01 27.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.56 2.173 . . . . 0.0 112.232 175.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -56.28 113.46 1.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.687 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.55 10.04 8.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.192 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 88.2 m -83.35 114.89 21.73 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.301 0.24 . . . . 0.0 110.454 176.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.463 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -122.5 162.51 21.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 111.259 -175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.53 HD23 HD22 ' A' ' 19' ' ' LEU . 2.0 pt? -159.18 128.48 5.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.541 172.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.456 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 p -94.97 121.06 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.759 0.79 . . . . 0.0 110.659 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.529 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 38.3 ptt85 -108.69 160.1 16.22 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.794 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -92.71 135.96 33.65 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -97.38 101.06 12.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.35 -34.8 58.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.942 -171.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.8 p -86.49 19.3 2.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -173.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.487 ' HB ' ' HB1' ' A' ' 40' ' ' ALA . 26.5 m -152.2 124.29 8.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.963 0.411 . . . . 0.0 110.087 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -70.32 104.75 2.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.611 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.93 5.78 65.89 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.083 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB1' ' HB ' ' A' ' 37' ' ' THR . . . -95.07 113.86 25.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.276 0.56 . . . . 0.0 110.312 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.45 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 71.9 m-85 -104.76 169.23 8.57 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.227 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.3 m -133.51 108.88 8.89 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.961 0.41 . . . . 0.0 110.542 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.456 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -83.07 84.77 7.34 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.5 t -81.27 127.82 33.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.383 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 13.9 p -125.61 138.61 53.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.0 t -78.25 119.45 21.64 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.725 0.774 . . . . 0.0 110.293 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -95.78 153.48 17.72 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.591 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -135.89 107.74 7.08 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.957 -175.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -90.77 139.81 30.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 173.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -84.13 -2.04 56.07 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -172.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -120.21 -51.22 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -84.62 -25.81 28.3 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.588 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.22 -166.69 12.17 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.081 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -79.3 146.25 33.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.104 0.478 . . . . 0.0 111.496 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -137.12 178.18 7.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.148 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 99.3 t -121.97 128.73 75.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.024 0.44 . . . . 0.0 110.306 177.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -111.26 95.53 5.58 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.547 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -76.94 91.58 3.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.458 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.479 ' HB3' HG22 ' A' ' 71' ' ' ILE . 70.4 m-85 -78.18 137.06 37.96 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -104.82 133.68 49.24 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.145 0.498 . . . . 0.0 110.982 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.721 HG12 HG12 ' A' ' 71' ' ' ILE . 66.6 mt -104.23 96.38 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.103 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.7 ttp180 -88.22 134.69 33.72 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.969 0.414 . . . . 0.0 110.421 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -82.42 127.73 33.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.773 177.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.7 mt -99.64 115.33 29.18 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.237 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.01 -25.74 67.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.326 0.584 . . . . 0.0 110.089 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -99.29 11.43 39.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.239 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.51 -102.43 0.18 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.955 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -161.78 -136.38 1.99 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.25 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -114.39 138.61 50.33 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.405 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 13.7 p90 -147.91 143.33 27.29 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.102 0.477 . . . . 0.0 110.959 177.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.721 HG12 HG12 ' A' ' 61' ' ' ILE . 57.9 mt -95.75 -36.76 6.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.159 174.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.01 148.18 52.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.365 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.447 ' O ' ' HD2' ' A' ' 74' ' ' ARG . 14.4 p -78.91 47.04 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -172.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 73' ' ' SER . 30.6 mmm180 -125.44 -62.72 1.19 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.4 m -108.93 133.4 53.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.63 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.405 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 72.6 mt-30 -129.17 135.22 48.56 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.538 0.209 . . . . 0.0 110.501 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -121.11 155.38 34.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.874 0.369 . . . . 0.0 110.867 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 p -93.41 -7.72 43.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 31.7 p -132.51 139.29 47.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.995 0.426 . . . . 0.0 110.146 177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.636 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.4 mt -68.47 -26.56 65.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.915 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -62.8 -47.3 84.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -71.23 -29.91 65.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.334 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.605 HD11 HD11 ' A' ' 71' ' ' ILE . 3.1 tm? -56.88 -62.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.045 176.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.8 m -64.35 -44.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.05 -46.28 71.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.74 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -73.78 -39.88 63.83 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.258 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.606 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 6.6 m-85 -74.0 -3.73 31.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.112 0.482 . . . . 0.0 111.536 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -82.26 -27.06 32.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 170.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.1 mttm -96.24 -49.91 5.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.807 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.606 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 35.1 m170 -125.53 119.29 27.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.2 174.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -70.45 -17.59 62.99 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.6 t70 66.55 -72.15 0.09 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.846 0.716 . . . . 0.0 111.193 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -116.31 -33.68 1.44 Allowed Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.575 HD13 ' HD2' ' A' ' 87' ' ' TYR . 5.4 mp -61.69 169.78 2.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.256 0.551 . . . . 0.0 111.057 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 41.8 t -116.35 -22.75 8.66 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.135 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.445 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 53.3 m80 -87.42 -32.02 19.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.202 -170.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 96' ' ' HIS . 49.5 mtp180 66.82 124.82 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.556 0.535 . . . . 0.0 110.018 -168.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.463 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 82.5 mt -61.03 104.45 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.607 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.6 m -96.02 -66.02 0.93 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.304 -173.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.405 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.9 p30 -133.02 150.13 52.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 5' ' ' TRP . 2.7 t -89.91 145.72 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.1 t -46.33 130.38 7.77 Favored Pre-proline 0 C--O 1.234 0.256 0 O-C-N 123.99 0.807 . . . . 0.0 112.308 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.45 151.5 82.94 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.043 2.495 . . . . 0.0 111.916 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.9 p -88.2 137.84 31.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.573 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.9 p -91.65 16.11 11.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.113 0.482 . . . . 0.0 110.766 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 117.941 -1.028 . . . . 0.0 108.889 -177.821 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 N--CA 1.482 1.171 0 CA-C-O 121.403 0.62 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 176.82 50.88 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.389 -1.278 . . . . 0.0 108.144 -173.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.28 153.56 30.35 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.599 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -45.01 -48.44 11.57 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.465 ' HE3' HG11 ' A' ' 31' ' ' VAL . 7.7 p-90 -81.84 -43.03 18.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.651 0.262 . . . . 0.0 111.447 -178.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.434 ' HA ' HG12 ' A' ' 31' ' ' VAL . 1.9 t80 -85.68 87.41 7.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.359 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 7.7 m-85 -67.04 -41.15 87.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.822 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.32 -165.61 18.41 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.752 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 pttm -84.29 73.65 10.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.506 0.669 . . . . 0.0 111.587 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.8 pt -94.61 144.99 8.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.986 175.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -84.23 177.53 8.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.244 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.459 ' HB3' ' OE2' ' A' ' 16' ' ' GLU . 25.1 mtp180 -56.08 -50.15 71.8 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -52.86 -37.51 60.43 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.365 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -79.45 -47.57 15.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.1 m -61.38 -49.24 77.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.984 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.459 ' OE2' ' HB3' ' A' ' 12' ' ' ARG . 42.1 mt-10 -68.27 -30.02 68.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.978 -177.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -59.89 -52.01 67.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.039 0.447 . . . . 0.0 110.858 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.636 HD21 ' OG1' ' A' ' 104' ' ' THR . 79.0 mt -70.12 -33.8 72.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.512 -174.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.767 HD22 HD22 ' A' ' 30' ' ' LEU . 55.1 mt -79.76 -32.9 41.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mp -81.27 8.78 8.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.79 0.328 . . . . 0.0 111.327 177.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.796 HD21 ' HG2' ' A' ' 23' ' ' GLU . 7.0 t30 -67.52 126.68 92.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 175.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.54 23.66 0.17 Allowed 'Trans proline' 0 N--CA 1.478 0.597 0 C-N-CA 123.493 2.795 . . . . 0.0 115.514 -167.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.796 ' HG2' HD21 ' A' ' 21' ' ' ASN . 11.3 pt-20 -122.34 10.35 9.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.312 0.577 . . . . 0.0 110.063 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -96.83 122.12 57.62 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.274 -177.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.405 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 83.6 Cg_endo -86.72 169.58 7.89 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.898 2.399 . . . . 0.0 111.758 173.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -61.89 112.2 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.591 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.69 2.8 6.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.399 -177.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 35.1 m -80.42 118.51 22.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CG ' HD21 ' A' ' 98' ' ' LEU . 28.7 p90 -129.78 165.83 21.14 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -173.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.767 HD22 HD22 ' A' ' 19' ' ' LEU . 1.8 pt? -164.64 145.84 8.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.3 171.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -108.15 124.45 64.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.328 0.585 . . . . 0.0 110.961 178.704 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.542 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 5.2 ptp180 -102.25 158.3 16.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.224 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -91.29 101.38 14.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' ALA . 34.5 t -73.93 111.78 9.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.111 0.481 . . . . 0.0 110.827 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.19 59.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 175.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 m -64.44 -36.33 83.83 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.813 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.9 m -147.6 109.46 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.325 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.59 132.84 53.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 92.01 1.74 69.76 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.827 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . -125.27 116.26 21.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.018 0.437 . . . . 0.0 109.864 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.663 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 90.4 m-85 -97.05 176.49 5.93 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.542 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 41.2 t -135.45 112.78 10.57 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.761 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.52 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.1 tm? -87.05 88.31 7.67 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.451 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 15.4 m -82.35 116.11 21.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.968 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 p -110.51 130.89 63.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.082 0.468 . . . . 0.0 110.038 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.51 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 41.4 t -78.24 122.58 25.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.341 177.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -116.87 123.68 47.63 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.943 -174.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.506 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 51.9 t80 -101.84 72.82 1.37 Allowed 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.497 ' HB2' ' HG2' ' A' ' 52' ' ' LYS . 15.5 m-20 -61.1 124.45 20.58 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.633 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.438 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.9 OUTLIER -75.26 53.1 0.63 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.567 0.699 . . . . 0.0 110.834 -179.456 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -162.22 -51.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.742 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.497 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 10.0 ptpp? -99.28 -23.58 15.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.173 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 97.89 -158.72 20.78 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.366 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.506 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 35.4 mt -64.55 120.67 12.78 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.403 0.621 . . . . 0.0 111.343 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' ND2' ' HD2' ' A' ' 52' ' ' LYS . 8.1 p30 -143.1 146.35 33.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.453 176.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.3 t -89.14 119.71 36.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.623 ' HZ1' ' HB2' ' A' ' 57' ' ' LYS . 3.5 ttmp? -95.99 100.81 12.44 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -80.07 89.84 5.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.303 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -78.5 142.85 37.12 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -115.01 117.38 30.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.178 0.514 . . . . 0.0 110.76 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.663 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 63.5 mt -87.86 92.74 3.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.792 -178.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -100.2 144.01 29.73 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.911 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.67 157.77 19.0 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.791 -0.363 . . . . 0.0 110.056 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 7.7 mt -70.1 -91.69 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.956 176.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -134.16 -34.37 0.98 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.6 t -149.07 -31.13 0.24 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.068 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.48 68.57 0.36 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.51 -1.329 . . . . 0.0 113.519 -172.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -178.28 94.6 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.758 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -83.05 125.41 31.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.435 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 15.8 p90 -126.06 132.72 51.89 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.498 0.666 . . . . 0.0 111.768 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.574 HG23 HD13 ' A' ' 94' ' ' LEU . 65.4 mt -93.35 -39.69 11.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 168.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -121.16 179.79 4.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.891 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.0 t -73.18 -43.74 60.94 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -69.54 -56.71 6.58 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -170.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.431 ' HB ' ' CE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.68 120.59 32.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -169.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.43 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 2.2 mp0 -111.99 131.8 55.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.788 170.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.463 ' CE2' ' HE1' ' A' ' 87' ' ' TYR . 98.9 m-85 -123.28 131.34 53.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.636 0.255 . . . . 0.0 110.465 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.29 5.23 27.54 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.86 0.362 . . . . 0.0 111.783 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.1 m -147.7 137.54 22.74 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.961 0.41 . . . . 0.0 110.404 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 84' ' ' VAL . 86.8 mt -72.75 -30.13 63.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.427 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -48.5 81.55 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -62.79 -35.72 80.79 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.565 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.46 HD11 HD12 ' A' ' 71' ' ' ILE . 2.8 tm? -58.34 -60.94 2.99 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.825 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -65.17 -44.13 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.48 -39.6 70.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.876 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -73.76 -48.52 31.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.592 0.235 . . . . 0.0 111.018 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.507 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 2.4 m-30 -69.99 -10.79 59.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.356 -177.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.511 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 10.7 t -70.28 -19.57 63.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.247 0.546 . . . . 0.0 110.132 176.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -116.15 -52.41 2.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.852 177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.507 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.1 t-160 -116.8 103.48 10.37 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.485 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' A' ' 97' ' ' ARG . . . -68.81 -27.34 65.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 -177.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.5 t70 70.11 -73.74 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.5 174.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.46 -49.57 2.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.794 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.587 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.3 mp -60.85 144.57 52.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.069 0.461 . . . . 0.0 110.643 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.9 t -74.6 -39.13 62.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -89.56 121.59 31.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.142 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.595 ' HA ' ' HB3' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -81.61 146.65 29.98 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.566 HD21 ' CG ' ' A' ' 29' ' ' PHE . 73.9 mt -69.04 85.68 0.35 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.218 0.532 . . . . 0.0 110.416 -177.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.7 m -78.17 -58.7 3.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.335 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.7 p-10 -132.94 143.74 49.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.949 -177.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.477 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -82.7 152.27 4.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.78 140.15 81.44 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.31 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.12 176.47 3.84 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.67 2.247 . . . . 0.0 111.167 172.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.636 ' OG1' HD21 ' A' ' 18' ' ' LEU . 24.0 p 57.39 -175.81 0.07 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.463 0.705 . . . . 0.0 110.797 -173.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.428 ' HA ' ' CE2' ' A' ' 7' ' ' PHE . 23.0 p -154.97 -10.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 0.0 111.159 175.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.216 179.383 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 120.943 0.402 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.02 119.99 40.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.436 173.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 52.8 mm-40 -79.09 178.41 8.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.065 -176.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -61.55 -52.46 64.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.002 0.429 . . . . 0.0 110.066 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 14.9 p-90 -79.79 -41.06 27.27 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.038 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.577 ' HE1' ' CE2' ' A' ' 41' ' ' TYR . 80.0 t80 -85.66 95.57 9.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.929 -177.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.571 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 30.6 m-85 -79.92 -20.96 44.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.209 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.76 -164.34 21.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.974 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.651 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 7.3 pttm -81.72 74.95 8.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.117 0.484 . . . . 0.0 111.846 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.651 HG13 ' HD2' ' A' ' 32' ' ' ARG . 39.4 pt -97.41 145.21 9.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -75.08 165.68 24.85 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.447 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 57.9 mtm180 -56.84 -51.0 70.72 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.104 0.252 . . . . 0.0 110.468 -176.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -49.48 -48.85 47.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.661 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.55 -47.58 84.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.299 0.571 . . . . 0.0 110.335 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 45.2 t -64.29 -47.3 80.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.326 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HA ' HG21 ' A' ' 56' ' ' VAL . 48.3 mt-10 -68.96 -34.75 75.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.589 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.4 -25.05 68.11 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.489 . . . . 0.0 110.336 177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -88.07 -39.37 14.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.519 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.487 HD22 HD23 ' A' ' 30' ' ' LEU . 88.4 mt -77.02 -25.46 52.64 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.4 mm? -77.54 4.4 11.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.426 ' C ' ' H ' ' A' ' 23' ' ' GLU . 43.6 t30 -83.14 109.77 19.41 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.1 Cg_exo -65.67 14.39 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.883 3.055 . . . . 0.0 114.409 -170.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.426 ' H ' ' C ' ' A' ' 21' ' ' ASN . 14.1 mm-40 -83.54 -3.67 57.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.785 0.326 . . . . 0.0 110.51 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -110.96 143.22 27.84 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.541 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -82.0 164.41 17.7 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 123.09 2.527 . . . . 0.0 112.458 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.472 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 54.4 ttp180 -68.82 106.25 2.62 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.868 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.93 2.92 2.08 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 -174.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 68.8 m -76.64 132.46 39.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.198 -0.501 . . . . 0.0 109.757 175.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.548 ' CG ' HD22 ' A' ' 98' ' ' LEU . 31.0 p90 -137.04 166.33 23.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.158 0.504 . . . . 0.0 112.002 -175.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.571 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.3 pt? -162.51 141.9 9.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.391 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.563 ' HB ' HD21 ' A' ' 43' ' ' LEU . 2.6 p -108.75 118.16 55.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.502 0.668 . . . . 0.0 110.666 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.651 ' HD2' HG13 ' A' ' 10' ' ' ILE . 11.3 mtm180 -104.58 162.07 13.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.179 -177.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.651 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.2 tt0 -97.63 129.91 44.69 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 174.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.2 m -67.85 140.98 56.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.519 0.676 . . . . 0.0 111.317 -176.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.74 -38.5 91.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.83 -177.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.6 p -103.21 -66.65 0.93 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.563 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.2 m -70.74 99.33 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.152 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.25 133.35 37.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.945 0.402 . . . . 0.0 109.923 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.69 -11.16 61.06 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -173.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.541 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -104.15 126.46 51.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.577 ' CE2' ' HE1' ' A' ' 6' ' ' TYR . 60.3 m-85 -117.34 143.33 46.07 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.175 0.512 . . . . 0.0 111.09 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.7 m -99.16 94.13 6.34 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 -176.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.686 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.2 tm? -81.24 98.38 8.07 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 172.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.7 m -97.86 132.83 43.11 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.729 -175.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.47 HG22 HD21 ' A' ' 94' ' ' LEU . 3.0 t -112.61 139.44 37.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.927 -177.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.4 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 78.6 p -77.41 96.73 4.74 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.708 0.766 . . . . 0.0 109.388 174.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.81 138.81 31.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.596 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.472 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 79.7 t80 -122.59 122.45 38.88 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.302 0.572 . . . . 0.0 110.972 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -106.59 152.53 23.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.146 173.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -84.13 -1.92 55.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.746 0.307 . . . . 0.0 111.289 -173.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -123.2 -44.64 2.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.883 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -82.06 -25.52 34.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.164 -177.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.76 -141.58 17.25 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.815 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 78.5 mt -82.86 137.5 34.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.249 0.547 . . . . 0.0 111.322 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -146.4 154.83 42.08 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.467 HG21 ' HA ' ' A' ' 16' ' ' GLU . 58.3 t -97.83 115.56 38.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.966 -178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -89.98 105.72 18.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.679 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -86.7 107.26 18.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.885 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.605 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 4.0 m-85 -95.85 135.0 38.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.959 0.409 . . . . 0.0 110.713 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -95.34 102.7 14.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.932 HG12 HG12 ' A' ' 71' ' ' ILE . 54.8 mt -82.24 87.01 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.1 mtm180 -86.01 156.07 20.6 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -107.94 155.49 20.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.297 0.57 . . . . 0.0 111.328 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 95.7 mt -108.18 141.21 40.27 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.912 -1.04 . . . . 0.0 108.868 172.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -64.3 -25.42 68.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.6 t -135.44 45.03 2.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.099 0.476 . . . . 0.0 110.13 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.09 -77.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.44 -157.03 28.62 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.005 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.447 ' HB3' ' CG2' ' A' ' 61' ' ' ILE . 73.5 m-85 -99.36 136.28 39.53 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.488 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 52.3 p90 -140.04 137.65 34.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.243 0.544 . . . . 0.0 111.078 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.932 HG12 HG12 ' A' ' 61' ' ' ILE . 45.2 mt -82.63 -26.73 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.898 0.856 . . . . 0.0 109.385 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 74' ' ' ARG . 8.8 t -155.59 167.87 28.98 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.269 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.9 t -80.71 54.39 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.686 0.755 . . . . 0.0 109.738 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.603 ' HB2' HG23 ' A' ' 72' ' ' THR . 13.7 mmm180 -126.34 -78.64 0.59 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.539 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.0 m -105.04 131.72 52.19 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.488 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 73.9 mt-30 -126.43 125.62 42.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.759 0.314 . . . . 0.0 110.8 -176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -121.54 141.11 51.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.312 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -78.49 -0.92 31.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -174.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.6 m -153.48 161.38 42.31 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' O ' HG21 ' A' ' 84' ' ' VAL . 96.0 mt -81.21 -19.8 42.46 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -168.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.6 tp60 -68.2 -45.19 74.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.632 ' HA ' HE21 ' A' ' 82' ' ' GLN . 0.0 OUTLIER -59.48 -32.86 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.898 175.059 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.412 HD13 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -59.64 -63.92 1.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.413 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.405 HG21 ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -64.16 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -176.338 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.72 -32.87 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -90.42 -44.58 9.55 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.223 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.565 ' HD2' HD13 ' A' ' 94' ' ' LEU . 16.1 m-85 -74.6 -7.16 52.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.562 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 23.0 p -79.26 -21.39 46.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.156 0.503 . . . . 0.0 109.707 172.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -100.96 -47.82 4.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.057 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.515 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 93.3 m-70 -127.14 117.79 23.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.446 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -67.55 -29.77 69.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.076 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.5 t70 64.75 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.561 0.538 . . . . 0.0 112.442 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -93.53 -34.84 6.44 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.605 ' HG ' ' CE2' ' A' ' 59' ' ' TYR . 4.0 mp -72.14 159.08 34.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.33 -0.435 . . . . 0.0 110.204 174.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 18.3 t -103.54 2.4 33.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.763 0.792 . . . . 0.0 108.877 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -123.91 112.05 16.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.311 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.9 ptt180 -68.49 136.48 53.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.4 mt -60.33 97.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.376 0.423 . . . . 0.0 109.977 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 11.2 m -89.68 -46.9 8.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.076 0.465 . . . . 0.0 111.291 -172.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.5 p-10 -146.92 154.17 40.98 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.703 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.9 t -91.62 155.37 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -177.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.3 120.22 24.61 Favored Pre-proline 0 C--O 1.236 0.347 0 O-C-N 123.535 0.522 . . . . 0.0 111.865 -177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -69.58 139.35 40.63 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 111.383 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 p -106.47 131.44 53.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.1 t -73.58 102.22 3.82 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? . . . . . 0 C--O 1.248 0.997 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.712 -175.846 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.35 0.595 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.15 118.4 30.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.104 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -70.2 154.23 42.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.449 -177.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -76.65 -42.94 40.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.525 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -75.26 -37.0 61.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.301 -172.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -86.35 105.23 16.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 0.0 110.68 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.48 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 22.7 m-85 -90.8 -11.41 39.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.32 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.74 -158.21 24.98 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.674 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 66.03 4.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.84 141.92 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.6 p -84.99 170.35 13.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.913 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -54.43 -51.06 66.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.702 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 35.7 ttp180 -53.37 -40.23 64.82 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.511 0.507 . . . . 0.0 110.793 -177.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -68.19 -53.61 23.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.2 m -61.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.235 -177.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.19 -24.04 63.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.208 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 38.6 ttp-105 -62.8 -37.97 88.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.789 176.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.31 -33.71 32.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.17 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.623 HD23 HD23 ' A' ' 30' ' ' LEU . 92.2 mt -78.87 -31.55 45.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -172.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.61 10.64 3.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 23' ' ' GLU . 5.4 m-20 -86.55 125.36 67.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-O 120.716 0.294 . . . . 0.0 110.329 175.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 14.3 Cg_exo -69.88 8.48 0.79 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.3 2.667 . . . . 0.0 112.57 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.409 ' H ' ' C ' ' A' ' 21' ' ' ASN . 29.2 mt-10 -82.43 -15.6 52.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.779 177.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -92.34 133.5 29.82 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.945 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HG2' ' ND2' ' A' ' 100' ' ' ASN . 57.5 Cg_endo -73.61 144.28 35.44 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.858 2.372 . . . . 0.0 111.631 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.574 ' HD3' ' O ' ' A' ' 48' ' ' PHE . 43.6 ttp180 -52.68 114.35 1.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.486 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.58 7.07 6.39 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.432 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 51.7 m -72.19 116.43 12.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.0 110.872 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.532 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.8 p90 -126.61 165.99 18.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.926 0.393 . . . . 0.0 111.203 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.623 HD23 HD23 ' A' ' 19' ' ' LEU . 2.1 pt? -164.0 142.49 7.48 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 171.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 p -106.68 124.24 62.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.674 0.75 . . . . 0.0 110.775 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.433 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 15.8 ptt180 -115.14 147.69 39.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.249 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -78.7 121.58 24.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.131 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.8 m -96.62 119.72 35.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.271 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.55 -22.71 40.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.073 -174.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.0 m -69.37 -21.88 63.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.009 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.561 HG23 ' H ' ' A' ' 39' ' ' GLY . 97.4 m -149.92 120.3 7.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.451 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -81.16 15.22 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.206 0.527 . . . . 0.0 111.34 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.561 ' H ' HG23 ' A' ' 37' ' ' THR . . . -134.2 22.48 3.77 Favored Glycine 0 C--N 1.307 -1.048 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.065 -176.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.35 108.75 2.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.791 0.329 . . . . 0.0 111.339 -178.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.656 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 35.3 m-85 -85.93 152.77 22.69 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 170.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.433 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -109.79 105.81 15.17 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.674 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -90.33 91.82 8.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 173.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -87.48 107.83 18.75 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.973 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.1 p -108.15 130.69 60.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.993 0.425 . . . . 0.0 110.475 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 42.7 t -87.36 124.2 33.13 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.628 0.727 . . . . 0.0 109.918 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.416 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 12.3 t70 -120.42 135.41 55.05 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.093 -176.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.574 ' O ' ' HD3' ' A' ' 26' ' ' ARG . 75.0 t80 -116.74 149.07 40.48 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.801 -178.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.498 ' HB3' ' HB3' ' A' ' 52' ' ' LYS . 16.7 t70 -140.93 146.37 37.31 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -73.4 -13.87 61.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.3 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.52 -37.67 2.75 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.554 ' HB3' ' HZ2' ' A' ' 52' ' ' LYS . 6.9 ttpm? -83.87 -25.23 30.42 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.862 0.363 . . . . 0.0 111.358 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.68 -164.98 34.75 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.929 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.9 mt -76.45 139.23 40.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.56 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -150.63 143.1 24.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.036 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.23 119.79 57.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.073 0.464 . . . . 0.0 110.4 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 44.0 mttm -94.19 99.46 11.71 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.67 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -80.99 86.81 6.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.319 -0.401 . . . . 0.0 109.93 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.496 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 45.5 m-85 -75.91 141.99 42.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.075 0.464 . . . . 0.0 110.885 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -98.69 109.36 22.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.778 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.791 HG12 HG12 ' A' ' 71' ' ' ILE . 54.3 mt -84.02 92.09 2.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.498 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -76.57 146.68 38.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.73 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.841 ' HE2' ' HA ' ' A' ' 65' ' ' ASP . 21.2 ptmt -110.89 148.54 32.23 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.207 0.527 . . . . 0.0 110.602 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.1 mt -90.13 26.98 1.73 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.666 173.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.841 ' HA ' ' HE2' ' A' ' 63' ' ' LYS . 13.4 t70 63.91 -66.26 0.11 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.879 -174.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 54.9 m -125.04 -11.71 7.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -177.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -79.45 -18.13 74.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.834 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.5 -170.43 23.03 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.154 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -120.45 138.41 53.81 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.635 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 38.5 p90 -143.81 130.16 19.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.36 0.6 . . . . 0.0 111.569 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.791 HG12 HG12 ' A' ' 61' ' ' ILE . 69.5 mt -77.97 -42.7 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.138 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 74' ' ' ARG . 2.5 t -115.45 151.33 34.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.13 174.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.2 p -76.06 21.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.951 0.405 . . . . 0.0 112.045 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.427 ' H ' ' C ' ' A' ' 72' ' ' THR . 40.6 mmt180 -104.69 -52.66 2.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.244 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.3 m -125.19 112.03 15.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.047 0.451 . . . . 0.0 111.714 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.635 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -109.85 150.87 27.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.354 176.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.472 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 88.0 m-85 -128.45 149.69 50.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.2 m -76.96 -12.05 59.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.212 0.529 . . . . 0.0 110.993 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 16.7 m -138.06 136.6 36.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.998 -177.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.547 ' O ' HG21 ' A' ' 84' ' ' VAL . 91.8 mt -69.83 -22.32 63.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.981 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -48.55 76.29 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.86 -34.76 78.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.413 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -55.2 -62.38 1.71 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.504 178.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.547 HG21 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -63.32 -41.63 93.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.856 -176.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.3 71.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.22 -43.04 65.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.207 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.601 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 5.8 m-85 -75.83 -2.11 28.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.138 0.494 . . . . 0.0 111.468 -176.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.0 t -78.96 -21.17 47.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.352 0.596 . . . . 0.0 109.392 172.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp -109.13 -49.5 3.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.979 177.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.601 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 76.0 m-70 -111.65 101.11 9.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.5 177.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.588 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -69.97 -33.97 72.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 t70 62.94 -82.79 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.249 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.17 -42.38 8.75 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.707 -0.557 . . . . 0.0 111.707 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.588 ' HB2' ' HB2' ' A' ' 91' ' ' ALA . 5.3 mp -63.04 143.17 58.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.244 0.545 . . . . 0.0 110.939 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.0 -17.81 60.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -140.32 132.71 28.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.314 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.566 ' HD2' ' H ' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -69.19 142.54 54.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.929 -179.658 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.532 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -60.87 109.77 1.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.169 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -98.97 -51.49 3.84 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -171.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 28' ' ' THR . 7.7 p30 -145.0 148.95 34.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.0 t -89.24 143.81 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.422 ' HA ' ' CG2' ' A' ' 28' ' ' THR . 51.4 t -55.81 126.54 65.54 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.058 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 20.6 Cg_exo -65.95 129.69 22.61 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.713 2.275 . . . . 0.0 111.162 174.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -102.23 -177.74 3.49 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.978 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.5 m 63.37 69.41 0.57 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.452 0.644 . . . . 0.0 110.71 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 53.4 tptt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.395 -178.323 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.902 0.382 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.38 85.3 1.78 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.251 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.6 mm-40 -78.96 101.13 7.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.487 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 28.19 -78.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 125.461 1.726 . . . . 0.0 114.342 -170.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 10.7 p-90 -76.77 -35.56 57.63 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.546 -174.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.435 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 88.3 t80 -94.93 99.99 11.92 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.202 -176.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HD2' ' HB2' ' A' ' 30' ' ' LEU . 42.2 m-85 -88.81 9.04 26.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.879 0.371 . . . . 0.0 111.923 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.01 -144.71 22.03 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.991 174.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -100.14 68.86 1.47 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.392 0.615 . . . . 0.0 111.636 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.0 pt -90.77 137.38 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.473 172.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -73.35 165.97 24.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.592 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.526 ' HD3' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -60.46 -37.8 82.15 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.581 -173.119 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.526 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 28.2 tpt180 -66.02 -40.32 90.98 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.528 -178.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.57 -45.84 88.63 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.987 0.422 . . . . 0.0 110.598 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -61.94 -48.88 78.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.814 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -67.93 -33.52 74.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.891 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 tpt85 -58.13 -29.14 65.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.018 0.437 . . . . 0.0 110.505 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.95 -38.99 14.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.953 177.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.594 HD21 HD22 ' A' ' 30' ' ' LEU . 76.8 mt -74.88 -20.05 59.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -174.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.23 14.46 3.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.593 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 27.0 t30 -62.58 115.07 14.29 Favored Pre-proline 0 C--N 1.33 -0.253 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 170.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 29.0 Cg_exo -62.66 -0.42 1.95 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.402 2.734 . . . . 0.0 114.281 -171.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -112.26 1.63 16.22 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.318 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.593 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 92.2 m-20 -66.74 128.7 93.98 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 10.0 Cg_exo -70.61 142.44 44.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.845 2.363 . . . . 0.0 111.285 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.412 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 47.8 ttp180 -64.81 110.95 2.58 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.88 2.61 6.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.688 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 58.7 m -75.28 118.12 17.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.532 ' CG ' HD21 ' A' ' 98' ' ' LEU . 32.4 p90 -124.57 161.31 26.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.123 0.487 . . . . 0.0 112.117 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.626 ' HB2' ' HD2' ' A' ' 7' ' ' PHE . 1.8 pt? -161.44 138.88 8.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 0.0 108.979 170.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.478 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.6 p -106.51 125.64 62.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.679 0.752 . . . . 0.0 111.09 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.417 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 24.8 ptt85 -116.15 150.01 38.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.317 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -88.31 127.22 35.47 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.1 m -79.9 110.26 15.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.13 0.49 . . . . 0.0 110.985 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -25.06 61.32 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.6 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.86 -3.77 58.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.689 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.5 m -155.0 94.75 1.67 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.576 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -84.84 38.75 0.72 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.716 0.769 . . . . 0.0 110.993 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.01 12.91 4.73 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.186 -1.165 . . . . 0.0 110.186 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.555 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -163.0 142.13 8.66 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.936 -0.632 . . . . 0.0 110.382 -175.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.551 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 50.8 m-85 -109.15 179.3 4.2 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 173.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.417 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -134.42 109.08 8.52 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.228 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.478 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -90.25 87.51 6.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.4 m -80.69 119.96 23.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.625 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.67 139.79 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.035 0.445 . . . . 0.0 110.265 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.7 t -83.49 119.64 24.93 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 121.722 0.772 . . . . 0.0 110.384 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.412 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 12.7 t70 -106.47 145.64 31.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.282 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.529 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 77.9 t80 -123.32 124.75 43.67 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.644 -173.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -111.89 140.74 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.221 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.464 HD21 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -82.62 -11.08 58.65 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -172.313 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.464 ' N ' HD21 ' A' ' 50' ' ' ASN . . . -113.51 -35.82 5.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.739 0.304 . . . . 0.0 111.136 -179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -87.5 -51.64 5.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.318 0.58 . . . . 0.0 110.32 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 131.83 -150.97 19.66 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -174.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.529 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.2 mp -90.54 139.31 30.81 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -125.73 130.37 51.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.2 t -93.25 112.68 26.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 121.23 0.538 . . . . 0.0 111.003 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -93.47 113.11 25.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.597 177.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.5 88.67 6.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.254 -176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -75.79 112.79 12.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 0.0 110.171 178.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -81.93 122.9 28.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.401 -177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.617 HG12 HG12 ' A' ' 71' ' ' ILE . 58.8 mt -92.07 92.09 3.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.138 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -75.01 146.01 41.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.262 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.718 ' HB2' ' HZ2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -107.19 156.08 19.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.302 0.572 . . . . 0.0 111.631 -178.088 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.8 mt -95.08 149.87 20.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 165.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.68 -61.45 2.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.936 0.398 . . . . 0.0 111.28 -175.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.0 m -117.79 35.23 4.79 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.38 -107.25 2.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.02 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.86 -170.42 17.24 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.325 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.466 ' HB3' HG23 ' A' ' 61' ' ' ILE . 82.2 m-85 -101.82 138.43 38.81 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.623 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 52.4 p90 -143.93 135.31 25.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.214 0.53 . . . . 0.0 110.786 -178.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.617 HG12 HG12 ' A' ' 61' ' ' ILE . 63.8 mt -82.9 -34.32 11.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.495 0.665 . . . . 0.0 109.373 174.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.5 t -126.95 154.77 44.11 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.647 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.1 m -77.88 56.01 1.49 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.164 0.507 . . . . 0.0 111.311 -175.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 74' ' ' ARG . 46.9 mtp180 -139.82 -71.6 0.38 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.656 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -105.28 104.81 14.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.207 -175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -111.7 154.58 24.76 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -136.89 137.6 39.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.912 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.8 p -69.62 -12.55 61.73 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.8 p -134.97 144.37 47.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.07 0.462 . . . . 0.0 110.061 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.538 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.0 mt -66.81 -21.74 66.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.578 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -59.52 -49.58 77.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.213 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -73.69 -26.54 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.628 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.29 -61.7 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.143 177.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -66.01 -44.33 92.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.599 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.79 -39.49 58.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.068 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -84.29 -40.85 17.48 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.062 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.63 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.3 m-30 -73.0 -7.87 53.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.894 0.378 . . . . 0.0 111.946 -176.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.517 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.3 m -86.1 2.33 47.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.346 0.593 . . . . 0.0 109.846 172.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -131.66 -38.32 1.16 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.48 -176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.63 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 74.8 m-70 -133.97 111.8 10.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.542 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -74.47 -35.15 63.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -173.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.7 t0 62.19 -82.41 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.891 0.744 . . . . 0.0 111.258 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -86.15 -37.5 9.07 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.837 -176.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.57 HD11 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -69.82 147.26 50.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.98 0.419 . . . . 0.0 110.913 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 70.2 m -73.22 -14.36 61.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.003 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -136.55 131.19 33.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.028 -177.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.542 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -64.68 133.97 53.27 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 172.731 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.532 HD21 ' CG ' ' A' ' 29' ' ' PHE . 81.1 mt -56.37 107.3 0.36 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.389 -176.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.6 m -96.64 -60.86 1.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.937 -172.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.424 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.6 p30 -131.89 149.47 52.43 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.19 143.53 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 54.0 t -50.71 120.45 13.14 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.63 -174.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.0 Cg_exo -71.33 130.77 17.92 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.969 2.446 . . . . 0.0 111.396 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 5.7 p -67.7 109.75 3.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.397 0.617 . . . . 0.0 110.892 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.7 m -83.59 60.19 5.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.505 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.8 pttp . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.009 179.692 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 121.35 0.595 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.38 -175.8 2.32 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.69 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.514 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 67.1 mm-40 -59.08 134.85 57.36 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' HG12 ' A' ' 101' ' ' VAL . 34.7 mt-10 -58.8 -27.53 65.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.1 -174.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.613 ' HA ' HG12 ' A' ' 101' ' ' VAL . 6.6 p-90 -104.91 -32.21 8.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.073 -175.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.548 ' HB2' ' CZ3' ' A' ' 5' ' ' TRP . 58.8 t80 -90.29 111.02 22.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.796 -174.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -106.68 25.42 11.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.537 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 72.57 -150.37 44.85 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.529 -0.629 . . . . 0.0 111.529 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.792 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 15.9 pttm -107.87 71.04 0.79 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.469 0.652 . . . . 0.0 110.589 175.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 pt -73.65 149.27 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.168 172.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -77.86 167.1 22.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.231 -176.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -58.48 -44.1 89.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.82 -0.173 . . . . 0.0 110.81 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 15.9 mmm180 -53.46 -45.12 69.41 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 123.355 0.409 . . . . 0.0 110.753 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -66.17 -50.38 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.673 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.514 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 18.0 t -60.65 -51.5 69.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.356 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.585 ' HB3' HD22 ' A' ' 20' ' ' LEU . 68.9 mt-10 -77.21 -20.03 55.89 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.633 -174.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 46.4 ttp180 -61.71 -36.07 79.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.43 0.634 . . . . 0.0 109.329 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.5 mt -81.87 -44.14 17.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.034 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.567 HD23 HD22 ' A' ' 30' ' ' LEU . 78.4 mt -72.38 -28.77 63.22 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -173.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 16' ' ' GLU . 4.3 mm? -82.88 19.67 1.32 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.958 0.408 . . . . 0.0 111.365 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.437 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.7 t-20 -99.59 119.69 59.42 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.477 ' HA ' HD12 ' A' ' 54' ' ' LEU . 23.2 Cg_exo -65.02 1.47 1.89 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.584 2.856 . . . . 0.0 114.521 -172.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -76.95 -16.88 59.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.409 . . . . 0.0 110.263 175.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -94.42 124.4 55.53 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.03 171.17 14.41 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.078 2.518 . . . . 0.0 112.765 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -58.88 109.66 0.87 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.62 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.43 -2.09 6.57 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.309 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 50.5 m -74.41 111.23 9.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.737 0.303 . . . . 0.0 110.327 176.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.502 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 34.5 p90 -127.26 166.39 17.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.99 0.424 . . . . 0.0 111.454 -175.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.567 HD22 HD23 ' A' ' 19' ' ' LEU . 1.8 pt? -162.32 145.27 11.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 170.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.501 ' HB ' HD22 ' A' ' 43' ' ' LEU . 2.8 p -107.87 123.78 63.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.793 0.806 . . . . 0.0 111.107 -176.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 30.4 ptt85 -126.92 138.14 53.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.348 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.792 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 7.7 tp10 -66.55 141.53 57.82 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.761 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 50.0 m -71.75 127.68 33.34 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.059 0.456 . . . . 0.0 110.023 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.601 ' HG2' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -58.43 -26.84 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.732 -175.346 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.601 HG23 ' HG2' ' A' ' 35' ' ' GLU . 17.2 p -118.66 24.21 11.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.818 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.761 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 7.3 m -141.03 137.19 32.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.869 0.366 . . . . 0.0 110.381 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -102.66 94.72 5.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.967 0.413 . . . . 0.0 110.705 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.76 50.83 2.06 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.352 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.421 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -159.19 99.3 1.48 Allowed 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 177.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.443 ' CE1' ' HE1' ' A' ' 6' ' ' TYR . 85.5 m-85 -89.92 139.41 30.62 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.705 -169.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 91.4 m -95.93 98.4 10.37 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.882 177.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.501 HD22 ' HB ' ' A' ' 31' ' ' VAL . 2.0 tm? -73.37 92.99 1.88 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 174.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 13.9 m -88.45 99.02 11.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.132 -174.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.9 p -101.97 125.38 56.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.257 0.551 . . . . 0.0 110.519 178.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.554 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 46.8 t -82.49 130.28 35.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.819 177.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.455 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 29.7 t70 -113.98 126.99 55.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.713 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -96.72 97.39 9.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.615 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -101.95 148.56 25.2 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.451 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -82.3 -20.79 36.73 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.246 -173.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -110.95 -46.33 3.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.959 0.409 . . . . 0.0 110.98 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -85.01 -15.34 44.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.201 -177.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.21 -156.61 35.91 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.825 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 22' ' ' PRO . 49.7 mt -76.95 106.29 8.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.546 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -119.56 125.38 48.67 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.711 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.14 120.02 37.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.441 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 55.3 mttm -93.59 103.03 15.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -83.37 90.05 7.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.189 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.456 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 71.7 m-85 -76.33 129.99 37.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.59 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -93.9 109.29 21.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.382 0.611 . . . . 0.0 110.844 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.449 HG12 HG12 ' A' ' 71' ' ' ILE . 68.1 mt -84.67 112.21 21.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.654 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -103.54 164.57 11.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.396 -177.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -118.08 133.7 55.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.082 0.467 . . . . 0.0 111.241 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.502 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 83.4 mt -88.06 136.76 32.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.951 175.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.67 -20.3 65.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.877 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.3 m -128.54 42.78 3.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.323 0.582 . . . . 0.0 110.627 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -168.39 -99.07 0.13 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.228 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -174.41 -147.99 6.37 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.621 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -88.14 142.5 27.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.713 0.292 . . . . 0.0 110.243 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.502 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 18.3 p90 -149.1 134.02 18.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.268 0.556 . . . . 0.0 111.049 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.566 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 70.3 mt -87.81 -26.71 5.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 169.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.3 t -146.5 152.86 39.67 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.925 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.8 m -82.19 56.24 3.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.915 0.388 . . . . 0.0 111.652 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -130.4 -54.75 1.1 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.999 0.428 . . . . 0.0 110.786 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -122.06 106.8 11.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -99.58 146.37 26.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.656 -176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.451 ' HB3' ' HB2' ' A' ' 82' ' ' GLN . 74.3 m-85 -136.98 135.98 38.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.991 0.424 . . . . 0.0 110.794 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.1 p -78.54 -27.12 45.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.089 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.455 ' HB2' ' HG3' ' A' ' 82' ' ' GLN . 4.3 m -110.47 135.79 50.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.478 . . . . 0.0 109.74 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.563 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.7 mt -65.74 -26.56 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.13 -178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -57.42 -40.83 79.17 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.23 0.538 . . . . 0.0 110.337 174.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.455 ' HG3' ' HB2' ' A' ' 79' ' ' SER . 40.0 mt-30 -71.0 -36.56 72.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.034 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.06 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.711 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -64.23 -42.52 95.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.076 -176.679 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.15 -50.3 71.53 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -72.89 -40.48 65.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 0.0 111.013 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.579 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.4 m-30 -75.7 -1.23 23.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.194 0.521 . . . . 0.0 111.331 -178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.8 t -75.55 -32.73 60.53 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.153 0.501 . . . . 0.0 109.768 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -105.46 -42.2 5.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.615 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.579 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.6 t-80 -101.3 100.75 11.3 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.73 74.32 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.362 0.414 . . . . 0.0 110.645 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 93' ' ' GLY . 1.6 t0 63.61 -86.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.568 172.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.405 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -103.47 -27.47 6.43 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.249 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.433 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.1 mp -70.64 145.52 50.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 110.521 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 40.8 t -68.76 -24.52 64.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.305 176.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -136.09 136.56 40.25 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 145.17 47.38 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.677 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.502 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -62.94 102.73 0.38 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.403 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.6 m -87.55 -67.08 0.85 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.851 -172.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.0 p-10 -135.94 144.32 45.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.132 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.613 HG12 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -90.0 145.06 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.8 t -73.47 132.9 80.88 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.243 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -88.12 173.06 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.027 2.484 . . . . 0.0 111.694 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 15.0 p -100.87 117.8 35.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.076 0.465 . . . . 0.0 111.038 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.9 t -129.15 32.15 4.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.843 -178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp . . . . . 0 C--O 1.244 0.804 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.824 -177.895 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 121.01 0.434 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' ' 6' ' ' TYR . . . -143.35 92.44 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 172.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.484 ' HB2' ' O ' ' A' ' 2' ' ' ALA . 53.6 mt-10 70.64 -174.78 0.18 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.041 -168.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.8 -43.69 62.44 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.558 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.4 ' HA ' HG12 ' A' ' 101' ' ' VAL . 27.1 p-90 -66.25 -43.15 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -172.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.493 ' HB3' ' O ' ' A' ' 2' ' ' ALA . 38.7 t80 -85.54 96.6 9.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.008 0.433 . . . . 0.0 110.502 -178.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -76.21 -62.68 1.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.342 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 138.36 -163.41 25.73 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -177.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.61 ' HB3' ' HB2' ' A' ' 33' ' ' GLU . 8.2 pttm -83.25 62.22 6.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 111.622 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 pt -78.03 132.33 32.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 169.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.3 p -74.68 177.56 6.04 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.815 -0.175 . . . . 0.0 111.399 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -58.79 -49.8 76.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -55.66 -36.01 66.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.361 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.637 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 35.9 mt-10 -78.4 -53.42 7.28 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.887 -177.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.1 p -62.21 -46.75 87.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.914 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.76 -48.52 76.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.085 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -59.11 -27.67 65.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.407 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 82.6 mt -71.88 -39.93 69.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 0.0 110.777 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.552 HD12 HG11 ' A' ' 56' ' ' VAL . 50.2 mt -87.55 -18.09 30.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.581 -175.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.2 mm? -77.73 8.01 5.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.124 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.459 ' OD1' ' HB2' ' A' ' 23' ' ' GLU . 21.1 t-20 -91.19 113.0 56.84 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.57 ' HA ' HD11 ' A' ' 54' ' ' LEU . 60.5 Cg_endo -73.57 9.52 1.53 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.07 2.513 . . . . 0.0 113.501 -173.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.459 ' HB2' ' OD1' ' A' ' 21' ' ' ASN . 29.3 mt-10 -93.0 -10.28 36.82 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.487 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 91.3 m-20 -92.12 133.8 29.64 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.636 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 22.5 Cg_exo -65.39 160.89 40.4 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.183 2.589 . . . . 0.0 112.951 -177.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.678 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 57.3 ttp180 -72.15 120.19 17.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.754 175.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.64 6.21 25.24 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.837 -176.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 87.7 m -73.06 117.21 14.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.535 ' CZ ' HG22 ' A' ' 101' ' ' VAL . 28.2 p90 -121.19 161.5 21.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.992 0.425 . . . . 0.0 111.923 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -166.16 135.02 3.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.127 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.454 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -99.49 125.3 53.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.602 0.715 . . . . 0.0 110.704 -178.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.584 ' CG ' ' HB2' ' A' ' 42' ' ' CYS . 5.4 ptm180 -112.3 148.19 34.72 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.939 -176.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.61 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 46.7 mt-10 -67.32 120.08 13.24 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 170.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.2 t -75.08 74.82 2.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 57.1 33.53 23.47 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.357 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.519 ' OG1' ' HD3' ' A' ' 9' ' ' LYS . 3.1 m 54.5 38.18 29.23 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.808 -176.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.1 m -79.16 103.85 9.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -61.51 124.06 19.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.919 0.39 . . . . 0.0 110.124 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.45 ' O ' ' HD2' ' A' ' 62' ' ' ARG . . . 106.89 -5.49 36.78 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.118 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -143.3 108.15 4.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.178 0.513 . . . . 0.0 111.254 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -118.5 139.66 51.09 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.584 ' HB2' ' CG ' ' A' ' 32' ' ' ARG . 35.7 m -97.63 104.56 16.59 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.052 -176.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.47 97.16 7.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.55 ' HG ' ' CD1' ' A' ' 19' ' ' LEU . 43.0 t -93.63 134.72 35.64 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.113 -177.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 p -133.13 141.36 44.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.517 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 p -78.34 115.23 17.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.251 0.548 . . . . 0.0 111.074 -178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.667 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 10.5 t70 -95.37 139.18 32.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.978 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.678 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 94.1 t80 -109.86 130.13 55.56 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.075 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -124.08 143.99 50.13 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -88.98 -8.37 54.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.148 0.499 . . . . 0.0 110.84 -172.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.15 -45.15 3.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.572 177.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -86.6 -37.09 18.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.434 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 114.93 -90.5 0.53 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.779 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.57 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.3 mt -130.19 147.62 51.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.021 0.438 . . . . 0.0 111.331 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -134.68 149.54 50.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.109 174.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.552 HG11 HD12 ' A' ' 19' ' ' LEU . 39.0 t -107.75 114.8 47.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.968 0.413 . . . . 0.0 110.471 178.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.667 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 67.0 mttm -95.42 108.18 20.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.356 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -88.7 88.86 7.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.92 0.391 . . . . 0.0 110.696 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -78.09 92.17 4.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.34 126.84 30.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.62 0.724 . . . . 0.0 110.932 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.865 HG12 HG12 ' A' ' 71' ' ' ILE . 70.1 mt -96.12 127.61 48.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.909 -176.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 39' ' ' GLY . 24.2 tpt180 -99.31 140.86 32.87 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -87.34 127.56 35.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 175.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.418 ' HG ' ' H ' ' A' ' 66' ' ' SER . 21.6 tp -75.53 125.93 30.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.556 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -60.8 -29.43 69.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.354 0.597 . . . . 0.0 109.891 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.418 ' H ' ' HG ' ' A' ' 64' ' ' LEU . 4.9 m -85.05 -45.42 12.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.998 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -118.77 -109.1 2.37 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.118 -1.039 . . . . 0.0 113.154 -172.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -130.46 -101.1 0.9 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.177 -173.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -133.07 150.4 52.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.645 0.259 . . . . 0.0 110.889 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -161.23 140.2 10.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.237 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.865 HG12 HG12 ' A' ' 61' ' ' ILE . 55.9 mt -85.08 -27.99 6.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.36 0.6 . . . . 0.0 110.071 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.669 HG21 ' HG2' ' A' ' 74' ' ' ARG . 4.4 t -151.06 150.86 31.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.86 -178.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.8 m -78.32 58.89 2.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.25 0.548 . . . . 0.0 111.504 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.669 ' HG2' HG21 ' A' ' 72' ' ' THR . 15.8 ptp180 -142.47 -28.71 0.59 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.936 175.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 36.9 m -139.2 124.49 19.12 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.549 177.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -126.23 144.53 50.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.741 -174.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.51 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 75.0 m-85 -130.96 179.53 5.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.744 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.3 m -95.13 -38.74 10.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.572 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 83.4 p -122.89 166.95 14.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.999 0.428 . . . . 0.0 110.666 -177.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.617 ' O ' HG21 ' A' ' 84' ' ' VAL . 86.1 mt -77.62 -17.1 58.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.993 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -48.03 64.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.312 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -61.04 -37.75 83.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.788 176.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -54.13 -66.55 0.38 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.089 . . . . 0.0 110.709 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.617 HG21 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -61.34 -43.33 96.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -176.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.51 -42.17 77.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.988 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -82.32 -40.09 21.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.162 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.602 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.0 m-85 -74.63 -4.62 38.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.112 0.482 . . . . 0.0 111.194 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.3 t -76.91 -26.46 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.544 0.687 . . . . 0.0 109.427 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -101.88 -47.63 4.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.796 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.602 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 10.6 t-80 -113.14 109.63 19.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.795 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.62 88.85 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.339 0.399 . . . . 0.0 110.8 -177.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.414 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 37.6 t70 67.52 -78.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.089 0.868 . . . . 0.0 112.5 169.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -106.14 -37.18 2.55 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.933 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.581 HD13 ' H ' ' A' ' 94' ' ' LEU . 5.0 mp -67.14 145.81 54.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.3 0.571 . . . . 0.0 110.966 178.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.23 -19.25 59.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.079 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -127.81 125.4 39.73 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -69.75 153.12 43.81 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.442 HD23 ' CG ' ' A' ' 29' ' ' PHE . 63.4 mt -74.45 94.82 2.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.01 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.2 p -89.12 -78.2 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.725 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -111.07 145.25 38.85 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.535 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -88.37 138.06 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.4 t -55.73 124.4 56.87 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.397 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.52 133.35 23.99 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.068 1.846 . . . . 0.0 110.927 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.0 t -66.56 150.01 49.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.152 0.501 . . . . 0.0 109.796 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.4 m -104.44 126.28 51.4 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.725 -170.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 65.1 tttp . . . . . 0 C--O 1.253 1.251 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.637 175.164 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 121.249 0.547 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.41 89.37 6.6 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.899 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -68.41 140.28 55.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.486 -179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -47.75 -53.17 16.03 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -170.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.5 p-90 -64.9 -40.9 95.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.489 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -85.48 85.51 7.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.102 0.477 . . . . 0.0 110.218 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.436 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 6.9 m-85 -67.75 -13.59 62.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.663 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 99.84 -148.03 18.4 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.983 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -95.79 50.52 1.21 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 0.0 110.801 -175.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.3 pt -75.02 147.31 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.7 p -73.85 157.32 36.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.074 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -56.9 -35.3 68.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.984 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 30.3 ttp180 -50.58 -57.18 8.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.874 174.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 27.4 mt-10 -68.61 -45.04 73.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.972 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.2 t -53.7 -58.58 6.68 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.708 -175.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.679 ' HB2' HG11 ' A' ' 56' ' ' VAL . 2.2 pt-20 -73.97 -36.02 64.54 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.456 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -56.73 -38.27 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.724 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 94.2 mt -63.65 -39.18 93.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.666 176.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.646 HD12 ' HG ' ' A' ' 44' ' ' SER . 30.4 mt -77.25 -15.75 59.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.152 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.534 HD21 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -76.71 -4.42 43.19 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 122.231 -0.293 . . . . 0.0 111.6 175.691 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -73.87 110.66 9.68 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -57.21 -14.52 15.51 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.487 2.791 . . . . 0.0 113.998 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.49 -10.67 59.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -98.89 138.49 20.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -88.09 173.15 5.0 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 123.198 2.599 . . . . 0.0 113.566 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.431 ' HD3' ' ND1' ' A' ' 96' ' ' HIS . 26.1 ttm180 -68.5 128.35 36.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.747 176.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -5.0 22.36 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.562 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.622 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 33.0 m -73.34 130.36 40.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.554 ' CG ' HD22 ' A' ' 98' ' ' LEU . 42.1 p90 -141.63 161.54 37.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.795 0.331 . . . . 0.0 111.501 -176.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.436 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.7 pt? -159.67 143.9 14.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.551 173.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -111.96 121.08 63.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.458 0.647 . . . . 0.0 110.801 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 32' ' ' ARG . 22.9 ptt85 -108.65 143.16 38.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.928 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -78.5 100.87 7.07 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.63 176.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -80.62 76.6 7.48 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -5.2 6.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.958 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -69.38 -26.57 64.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.283 0.563 . . . . 0.0 109.767 171.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.0 m -139.22 92.18 2.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.423 176.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -60.83 120.81 10.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.999 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 107.43 -6.27 36.07 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.196 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -114.49 95.61 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.323 0.582 . . . . 0.0 110.565 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.731 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.7 m-85 -87.07 148.97 25.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.904 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 59.3 m -109.39 106.12 15.78 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.665 -178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.669 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.4 tm? -86.82 90.48 8.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 174.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.646 ' HG ' HD12 ' A' ' 19' ' ' LEU . 45.3 t -81.89 129.73 34.85 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.463 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.25 143.18 41.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 120.932 0.396 . . . . 0.0 110.676 -176.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -83.44 113.82 21.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.114 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 8.2 t70 -93.92 142.58 27.22 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -126.51 118.1 24.22 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.958 0.409 . . . . 0.0 110.54 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -129.2 144.01 51.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.868 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -89.45 31.72 0.9 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.947 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -137.26 -49.57 0.61 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.304 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -99.16 -8.32 25.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.157 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.51 -134.92 12.87 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.232 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.1 mp -88.26 131.03 34.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.797 0.332 . . . . 0.0 110.59 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 30.8 m-80 -119.94 130.65 54.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.679 HG11 ' HB2' ' A' ' 16' ' ' GLU . 84.8 t -102.32 116.43 45.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.294 0.569 . . . . 0.0 111.022 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -109.62 116.99 32.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.331 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -89.07 99.79 12.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.878 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.444 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 31.3 m-85 -79.49 155.19 28.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.21 0.529 . . . . 0.0 111.424 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 1.9 mtmt -98.25 107.84 20.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.18 -169.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.894 HG12 HG12 ' A' ' 71' ' ' ILE . 35.7 mt -99.01 75.71 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -98.28 133.64 42.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.462 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -71.96 139.42 48.66 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.888 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.25 147.92 51.54 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 169.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -45.47 -47.3 14.0 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.639 0.587 . . . . 0.0 111.375 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.0 m -139.86 48.4 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.971 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -134.06 -107.34 0.97 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.354 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -151.24 -170.66 18.43 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.786 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -91.01 141.23 29.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.695 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.481 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 53.5 p90 -145.11 143.57 30.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.648 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.894 HG12 HG12 ' A' ' 61' ' ' ILE . 54.4 mt -90.95 -21.82 6.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 122.014 0.911 . . . . 0.0 108.934 172.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.639 HG23 ' HB3' ' A' ' 92' ' ' ASP . 4.2 t -149.29 153.49 37.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.541 -1.209 . . . . 0.0 109.13 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 m -78.37 46.79 0.65 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 111.828 -174.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -131.13 -67.03 0.72 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.275 0.56 . . . . 0.0 109.592 178.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.1 m -103.95 148.96 25.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.534 177.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.481 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.7 pt20 -159.48 148.69 18.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.599 0.237 . . . . 0.0 110.92 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -137.38 149.97 47.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 111.033 -176.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.8 t -82.69 -15.12 53.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.869 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.6 m -128.32 141.58 51.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.414 ' O ' HG21 ' A' ' 84' ' ' VAL . 82.7 mt -67.6 -27.51 66.97 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.483 -173.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -66.82 -46.66 74.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.36 -30.68 71.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.654 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.533 HD12 HD12 ' A' ' 71' ' ' ILE . 3.4 tm? -54.03 -68.04 0.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.866 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -61.98 -42.64 95.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.889 -177.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.21 -47.2 72.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.082 -179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -81.0 -33.66 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.421 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.449 ' HD1' ' O ' ' A' ' 83' ' ' LEU . 26.5 m-85 -70.85 -7.35 44.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.955 0.407 . . . . 0.0 111.465 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.1 m -79.86 -16.85 54.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.661 171.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -109.4 -27.36 9.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.33 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.441 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 0.1 OUTLIER -131.42 105.23 7.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.751 -176.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.48 -41.18 66.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.792 0.33 . . . . 0.0 110.864 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.639 ' HB3' HG23 ' A' ' 72' ' ' THR . 0.8 OUTLIER 59.89 -87.43 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.797 176.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -95.12 -30.57 8.19 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.112 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.566 HD13 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -68.96 141.49 54.94 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.148 177.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.1 -17.3 62.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.628 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.431 ' ND1' ' HD3' ' A' ' 26' ' ' ARG . 80.6 m-70 -137.26 130.28 30.65 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -71.65 148.98 45.98 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 177.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.554 HD22 ' CG ' ' A' ' 29' ' ' PHE . 54.0 mt -62.39 120.09 10.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.546 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.5 m -111.43 -60.68 1.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.081 0.467 . . . . 0.0 110.933 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.622 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.9 p-10 -133.25 141.63 48.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.686 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.7 t -79.9 149.89 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.5 t -55.15 121.58 37.36 Favored Pre-proline 0 C--N 1.328 -0.349 0 O-C-N 123.645 0.591 . . . . 0.0 110.775 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -83.54 138.12 8.31 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.54 2.16 . . . . 0.0 111.515 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.4 p -68.09 127.34 32.51 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 p -63.62 123.61 19.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.57 -175.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 C--O 1.248 1.01 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.002 -179.739 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.811 0.338 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.02 166.19 29.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.94 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -118.78 123.0 43.73 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -53.92 -34.61 60.07 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -166.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.6 p-90 -82.33 -35.86 27.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CE2' ' HA2' ' A' ' 8' ' ' GLY . 64.9 t80 -87.22 109.29 19.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.967 0.413 . . . . 0.0 110.721 -177.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.6 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 40.0 m-85 -96.86 19.85 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.224 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.487 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 65.55 -141.53 42.57 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.357 177.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.593 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 58.8 mtmt -107.35 87.82 2.59 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.178 0.513 . . . . 0.0 110.848 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.8 pt -103.19 155.7 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.305 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 p -84.94 174.77 9.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -59.67 -48.44 81.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.103 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -54.96 -43.13 73.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.015 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.08 -52.25 66.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.003 0.43 . . . . 0.0 110.669 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -67.35 -47.98 68.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.143 -176.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.64 -42.08 87.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.57 -175.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -55.72 -41.47 73.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.075 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.85 -44.32 55.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.336 -177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.48 HD12 ' CD2' ' A' ' 30' ' ' LEU . 79.0 mt -78.4 -26.35 46.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -172.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 20' ' ' LEU . 4.0 mm? -81.2 3.85 22.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 111.448 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.497 ' C ' ' H ' ' A' ' 23' ' ' GLU . 94.3 m-20 -73.99 138.02 76.1 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.85 30.37 0.29 Allowed 'Trans proline' 0 N--CA 1.472 0.222 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.497 ' H ' ' C ' ' A' ' 21' ' ' ASN . 33.5 mt-10 -121.37 7.47 10.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.72 -178.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.409 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 48.7 m-80 -107.54 115.06 59.94 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.569 -178.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 52.1 Cg_endo -69.04 145.8 62.52 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.462 2.108 . . . . 0.0 110.444 170.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.654 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 55.2 ttp180 -60.71 114.67 3.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.25 6.15 7.64 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.35 -172.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.785 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 94.2 m -84.27 112.47 20.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.75 0.31 . . . . 0.0 110.316 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 33.5 p90 -117.09 158.28 24.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.055 0.455 . . . . 0.0 112.114 -171.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.6 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.8 pt? -154.02 138.05 16.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 170.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.506 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.61 118.26 55.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.446 0.641 . . . . 0.0 110.869 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -111.13 149.39 30.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.825 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.593 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 44.1 tt0 -92.43 130.5 38.09 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -107.51 98.54 8.14 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -72.21 -1.99 17.15 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.378 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.8 p -64.92 -19.48 65.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.601 0.715 . . . . 0.0 109.756 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.79 159.91 22.25 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.082 176.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -80.17 71.9 6.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.124 0.488 . . . . 0.0 110.811 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.37 32.23 12.32 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.843 176.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.67 141.17 30.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.92 0.391 . . . . 0.0 110.18 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.654 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.0 m-85 -117.3 165.4 13.51 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.54 -175.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.0 m -127.66 108.58 10.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.135 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.566 ' HB2' HD12 ' A' ' 61' ' ' ILE . 2.5 tm? -89.95 90.57 8.22 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.0 m -89.11 123.29 33.25 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.456 ' CG1' ' HB2' ' A' ' 57' ' ' LYS . 14.3 p -112.22 130.31 66.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.229 177.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.45 ' HB3' ' HB ' ' A' ' 28' ' ' THR . 46.8 t -68.03 121.69 16.64 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.654 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 16.5 t70 -122.15 154.5 37.33 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.741 -170.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -135.87 95.8 3.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.502 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.51 118.18 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -75.1 60.53 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.66 0.743 . . . . 0.0 109.765 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.08 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.433 -1.258 . . . . 0.0 108.705 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -108.3 -63.7 1.3 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.81 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.74 -151.86 21.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.875 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.2 128.38 35.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.254 -178.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -151.59 177.53 10.25 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.21 119.95 59.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.664 0.269 . . . . 0.0 110.885 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.456 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 52.8 mttp -87.24 103.94 15.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -84.75 86.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.277 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.593 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 45.7 m-85 -72.41 127.77 33.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.178 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -83.39 124.84 31.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.042 0.449 . . . . 0.0 111.403 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.772 HG12 HG12 ' A' ' 71' ' ' ILE . 57.3 mt -102.25 106.33 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.676 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 62' ' ' ARG . 11.4 mmt85 -108.81 172.18 6.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.224 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 51.9 mtmt -123.9 157.74 33.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.197 0.522 . . . . 0.0 111.659 -177.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.415 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 60.1 mt -123.51 151.09 43.17 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.724 178.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.33 -64.71 0.74 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 111.145 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 65.8 m -103.1 22.46 13.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.118 0.485 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 64' ' ' LEU . . . -112.97 -97.02 2.28 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.644 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 158.79 -149.69 19.92 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.61 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -80.75 126.6 31.51 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.476 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 30.3 p90 -140.48 141.15 35.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.249 0.547 . . . . 0.0 110.271 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.772 HG12 HG12 ' A' ' 61' ' ' ILE . 23.9 mt -101.84 -6.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 122.31 1.053 . . . . 0.0 108.546 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.916 HG21 ' HA3' ' A' ' 93' ' ' GLY . 2.5 t -169.5 160.01 8.86 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.649 -173.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.2 p -74.12 0.38 14.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.757 0.313 . . . . 0.0 111.011 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -67.82 -54.73 16.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.443 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m -142.25 141.35 32.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.872 -174.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 24.7 mp0 -125.19 138.1 54.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.93 178.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -130.75 140.74 50.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 0.0 111.191 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.7 p -82.22 -8.63 59.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.332 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 24.7 m -131.23 132.73 44.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.032 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 84' ' ' VAL . 53.4 mt -64.65 -30.32 71.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.871 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.72 -46.15 84.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.329 175.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.579 ' HA ' ' OE1' ' A' ' 82' ' ' GLN . 7.9 mm-40 -77.0 -21.25 54.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -178.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 71' ' ' ILE . 3.2 tm? -62.59 -59.69 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.509 174.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.93 -42.03 88.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.945 -178.215 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.0 -22.09 62.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -91.73 -48.88 6.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.739 0.304 . . . . 0.0 110.591 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.724 ' HD2' ' HG ' ' A' ' 94' ' ' LEU . 7.0 m-85 -73.13 -5.47 39.32 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.789 -176.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.9 p -78.67 -33.0 47.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.261 0.553 . . . . 0.0 110.244 173.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -95.8 -51.65 4.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.141 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -120.89 107.27 12.49 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.323 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -62.58 -37.5 86.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.479 -176.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.41 -72.27 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.193 172.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.916 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -104.01 -22.68 8.63 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.724 ' HG ' ' HD2' ' A' ' 87' ' ' TYR . 15.4 mt -79.42 155.5 28.32 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 35.4 t -82.39 -29.18 30.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.34 0.59 . . . . 0.0 109.937 177.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -127.34 125.62 41.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.36 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -72.41 137.72 46.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.016 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.581 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 59.6 mt -61.42 100.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.791 -174.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -97.73 -53.38 3.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.697 -173.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.785 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 t30 -127.08 136.07 51.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.965 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.446 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -87.01 148.31 4.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.862 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.2 t -50.73 125.21 21.25 Favored Pre-proline 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 111.659 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -69.73 144.87 55.61 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.021 2.481 . . . . 0.0 111.749 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.4 p -102.65 158.63 16.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.107 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 3.1 p -80.21 59.68 3.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.465 0.65 . . . . 0.0 110.009 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt . . . . . 0 C--O 1.25 1.102 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.566 -177.175 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 121.907 0.86 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.49 65.48 0.88 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.676 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -83.26 -163.3 0.72 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.635 -170.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.469 ' O ' HG13 ' A' ' 101' ' ' VAL . 50.1 mt-10 -57.11 -40.77 77.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.045 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.573 ' HA ' HG13 ' A' ' 101' ' ' VAL . 4.6 p-90 -84.19 -41.62 16.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.504 ' HE1' ' HA2' ' A' ' 8' ' ' GLY . 2.6 t80 -85.41 104.36 15.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.665 -174.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -94.68 -2.66 50.82 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.504 ' HA2' ' HE1' ' A' ' 6' ' ' TYR . . . 79.14 -169.31 53.9 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.795 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.44 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 51.9 pttt -67.1 98.75 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 110.982 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.1 pt -125.66 141.58 45.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.486 172.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.2 p -73.73 152.37 40.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.258 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -60.01 -34.94 74.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.016 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.61 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 11.5 ptm180 -55.03 -41.88 71.91 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.334 0.396 . . . . 0.0 111.007 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.489 ' HG2' ' HG3' ' A' ' 13' ' ' ARG . 4.9 mm-40 -82.17 -47.61 12.3 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 33.3 t -59.17 -49.3 78.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.674 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HB2' HG13 ' A' ' 56' ' ' VAL . 3.9 pt-20 -79.9 -31.49 40.21 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.23 -174.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.61 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 24.0 ttm180 -58.13 -36.53 73.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 174.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 105' ' ' SER . 71.0 mt -60.48 -44.77 95.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.976 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.557 HD11 HG11 ' A' ' 56' ' ' VAL . 44.7 mt -74.79 -22.92 58.48 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.779 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD23 HG23 ' A' ' 56' ' ' VAL . 2.1 mm? -74.03 -7.95 54.33 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.419 175.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.425 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 94.0 m-20 -80.42 119.95 77.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' HA ' HD11 ' A' ' 54' ' ' LEU . 13.1 Cg_exo -70.35 44.61 0.47 Allowed 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.484 2.789 . . . . 0.0 113.156 -177.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -115.39 -0.46 13.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.948 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -123.09 145.42 45.98 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.152 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -87.62 172.06 5.87 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.954 2.436 . . . . 0.0 112.439 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -64.15 125.73 25.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.927 177.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.54 12.14 21.84 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.327 -0.94 . . . . 0.0 112.126 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.534 ' HB ' ' OG ' ' A' ' 46' ' ' SER . 32.6 m -81.75 116.31 21.39 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 173.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.449 ' CG ' HD21 ' A' ' 98' ' ' LEU . 38.2 p90 -121.9 168.61 11.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.769 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.71 127.96 3.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 171.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.455 HG13 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -91.34 109.61 21.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.023 0.916 . . . . 0.0 110.088 177.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 32' ' ' ARG . 18.7 ptt180 -109.49 153.98 23.3 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.587 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.61 152.48 24.8 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.725 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 3.0 p -59.8 125.66 24.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.89 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.07 -53.27 7.59 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.738 -175.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.9 p -108.88 -11.42 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.219 0.533 . . . . 0.0 110.474 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 6.0 m -91.61 158.93 16.14 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.514 -0.767 . . . . 0.0 108.958 175.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -118.41 80.28 1.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.143 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.11 54.51 0.52 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.389 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.84 88.84 1.13 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.158 0.504 . . . . 0.0 109.868 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.592 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 64.6 m-85 -64.0 141.22 58.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.077 -175.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.44 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 48.5 t -109.22 107.08 17.21 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.142 0.496 . . . . 0.0 110.576 -177.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -86.93 87.58 7.49 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t -87.06 132.2 33.88 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.6 p -126.46 140.15 49.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.874 0.368 . . . . 0.0 110.23 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.534 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 97.8 p -88.28 139.54 30.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.144 -178.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -123.87 126.87 47.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.325 0.583 . . . . 0.0 110.28 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -106.91 89.19 2.93 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.686 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.84 152.14 20.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.287 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -100.16 10.42 41.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.043 -174.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.01 -42.28 2.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.023 0.439 . . . . 0.0 110.425 176.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.54 -36.01 10.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.592 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 106.59 -156.77 16.05 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.967 -0.635 . . . . 0.0 111.57 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.476 HD11 ' HA ' ' A' ' 22' ' ' PRO . 20.7 mt -69.9 124.46 24.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.882 0.372 . . . . 0.0 110.965 177.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -136.56 146.41 46.12 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.557 HG11 HD11 ' A' ' 19' ' ' LEU . 86.4 t -109.51 127.83 66.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.29 0.567 . . . . 0.0 111.217 -175.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -107.65 98.9 8.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.085 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -79.15 95.99 5.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.228 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.501 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 69.5 m-85 -84.8 148.29 26.4 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -114.31 122.05 45.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.092 0.473 . . . . 0.0 111.562 -173.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.592 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 83.5 mt -89.47 93.89 4.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.309 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -96.21 156.29 16.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -74.6 146.13 42.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.419 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.708 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 1.4 tt -53.79 -60.5 3.23 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.689 0.757 . . . . 0.0 109.884 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.5 t70 174.12 -30.29 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 113.477 -1.692 . . . . 0.0 107.582 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -125.39 -62.33 1.21 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.67 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.39 67.5 0.25 Allowed Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.951 -1.119 . . . . 0.0 113.265 -176.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -150.59 140.85 8.22 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -109.24 133.1 53.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.216 0.508 . . . . 0.0 110.098 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.708 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 53.6 p90 -148.03 149.07 31.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.482 HG12 HG12 ' A' ' 61' ' ' ILE . 58.3 mt -95.98 -20.89 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.978 0.894 . . . . 0.0 109.156 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -148.61 147.75 29.33 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.911 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m -76.12 55.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -138.49 -35.54 0.6 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -126.01 120.41 30.22 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.16 -0.216 . . . . 0.0 110.522 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -114.78 136.74 52.75 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -124.06 153.78 40.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.409 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.6 m -92.46 -19.4 22.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.091 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.2 p -131.16 145.7 52.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.951 0.405 . . . . 0.0 110.503 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.505 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.9 mt -75.89 -21.75 56.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -63.25 -43.11 98.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.168 175.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -73.24 -27.1 61.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.603 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.98 -62.81 1.55 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.064 177.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -63.63 -42.62 96.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -176.643 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.43 92.8 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.697 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -75.88 -42.19 49.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.876 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.565 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.1 m-85 -76.25 0.64 18.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.23 0.538 . . . . 0.0 111.79 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 t -80.97 -30.28 35.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 170.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -96.06 -40.08 9.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.853 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.565 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 3.5 m-70 -110.18 113.08 25.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.291 177.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.28 82.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.764 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.9 t70 68.23 -70.74 0.12 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.532 -1.213 . . . . 0.0 112.116 168.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -131.02 -29.71 0.6 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.331 -0.462 . . . . 0.0 111.981 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.564 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -60.93 -39.84 90.95 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.84 0.829 . . . . 0.0 112.275 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.4 t 83.17 -29.65 0.09 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 112.429 -2.169 . . . . 0.0 110.162 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -97.01 124.68 41.05 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 172.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.78 141.67 44.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.289 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.449 HD21 ' CG ' ' A' ' 29' ' ' PHE . 66.8 mt -66.09 94.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.002 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.1 m -91.8 -63.81 1.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -172.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.41 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.4 p30 -133.24 163.35 29.49 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.573 HG13 ' HA ' ' A' ' 5' ' ' TRP . 1.4 t -102.26 145.64 11.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.026 0.441 . . . . 0.0 110.892 -174.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.9 t -57.74 137.29 82.87 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.43 -176.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 4.8 Cg_exo -76.33 176.54 9.93 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.527 2.818 . . . . 0.0 112.004 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 14.2 p -90.69 164.78 14.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.216 -178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.789 ' HB2' HD23 ' A' ' 18' ' ' LEU . 27.5 t -88.88 150.36 22.91 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 111.749 -173.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.7 pttt . . . . . 0 C--O 1.252 1.195 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.742 173.897 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.23 96.27 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.973 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -86.69 -179.33 6.56 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.915 -177.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -56.27 -48.46 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.38 0.61 . . . . 0.0 110.216 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.665 ' HA ' HG12 ' A' ' 101' ' ' VAL . 8.4 p-90 -89.55 -44.3 10.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.3 -177.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.454 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 3.2 t80 -82.32 86.36 6.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.404 -175.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.54 ' CE2' ' HB ' ' A' ' 104' ' ' THR . 11.2 m-85 -69.86 -31.5 69.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.26 0.552 . . . . 0.0 110.847 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.8 -148.35 18.9 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.355 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -83.76 68.8 10.04 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.73 0.3 . . . . 0.0 111.343 -174.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.7 pt -95.47 150.01 4.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 p -82.3 166.38 19.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -71.06 -20.71 62.33 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -65.18 -44.79 87.34 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.57 -51.97 24.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.708 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 t -51.89 -68.42 0.17 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.624 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -29.29 66.61 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -61.25 -58.05 9.88 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.195 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 mp -63.96 -36.51 84.2 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.668 HD23 HD21 ' A' ' 30' ' ' LEU . 89.3 mt -70.54 -40.93 73.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.648 -177.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.33 57.96 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.324 0.583 . . . . 0.0 111.023 178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -121.08 119.25 29.83 Favored Pre-proline 0 C--N 1.321 -0.664 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 172.479 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 31.8 Cg_exo -60.28 -11.67 17.13 Favored 'Trans proline' 0 N--CA 1.473 0.321 0 C-N-CA 123.283 2.655 . . . . 0.0 113.187 -176.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -79.61 -19.15 49.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.95 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -87.92 130.31 47.06 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.046 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -84.85 166.99 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.683 2.255 . . . . 0.0 112.58 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.466 ' HD2' ' CE1' ' A' ' 96' ' ' HIS . 53.1 ttp180 -57.1 128.74 38.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.447 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.66 1.3 30.71 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.902 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 70.9 m -77.66 119.88 21.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 175.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.571 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.4 p90 -134.45 174.08 10.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.909 0.385 . . . . 0.0 111.74 -173.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.668 HD21 HD23 ' A' ' 19' ' ' LEU . 2.0 pt? -171.13 147.59 2.58 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.036 171.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.413 HG13 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -101.26 118.08 47.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.443 0.64 . . . . 0.0 110.771 179.261 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -117.31 155.71 29.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.121 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -99.63 135.83 40.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.002 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.433 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 43.1 t -84.71 121.6 27.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.009 0.433 . . . . 0.0 111.097 -178.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -81.0 -18.18 47.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.48 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.59 -28.19 26.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.747 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 61.7 m -135.06 93.24 2.97 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.194 0.521 . . . . 0.0 110.627 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.433 ' HD2' ' O ' ' A' ' 34' ' ' SER . 14.3 mmmm -71.72 113.23 8.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.851 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 122.62 3.13 9.43 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.49 -175.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.97 116.67 10.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.013 0.435 . . . . 0.0 109.908 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.77 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 17.4 m-85 -92.66 161.64 14.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.655 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 60.8 m -118.67 101.32 8.02 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.969 0.414 . . . . 0.0 110.71 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.3 tm? -77.56 97.95 5.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.453 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 5.0 m -92.34 105.63 17.79 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.122 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -113.56 136.67 49.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.043 0.449 . . . . 0.0 110.892 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.6 t -86.96 127.15 35.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.481 0.658 . . . . 0.0 110.632 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.447 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 7.4 t70 -112.34 140.08 47.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.791 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.423 ' CB ' ' HB2' ' A' ' 26' ' ' ARG . 78.9 t80 -111.11 114.88 28.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.091 0.472 . . . . 0.0 110.457 -176.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -112.35 153.75 26.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.072 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -75.51 -20.23 58.86 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.997 -172.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -112.25 -49.41 2.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -80.35 -17.48 51.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -176.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.71 -146.05 28.11 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.869 -0.682 . . . . 0.0 111.891 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.33 125.12 28.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.89 0.376 . . . . 0.0 110.373 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -131.37 138.11 49.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 77.9 t -98.64 124.23 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.165 0.507 . . . . 0.0 110.91 -176.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.447 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 57.0 mttm -102.88 116.68 33.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.974 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -91.69 94.94 9.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.583 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.464 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 62.3 m-85 -77.14 128.95 35.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.347 178.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -81.84 116.65 21.61 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 -176.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.5 mt -96.44 84.09 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.41 ' HD2' ' OH ' ' A' ' 70' ' ' TYR . 43.9 ttm180 -90.12 139.04 31.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.474 . . . . 0.0 111.328 -172.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.604 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . 51.4 tttp -90.13 133.3 34.96 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.352 177.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.2 -81.36 0.13 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 177.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -170.13 -64.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.419 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 34.0 p -120.25 -23.28 6.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.714 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -64.7 -52.47 42.37 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.216 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.16 -147.64 19.32 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.344 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.604 ' CE2' ' HB2' ' A' ' 63' ' ' LYS . 84.2 m-85 -108.87 141.27 41.17 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 48.9 p90 -135.53 143.66 45.86 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.289 0.566 . . . . 0.0 111.398 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.496 HG12 HG12 ' A' ' 61' ' ' ILE . 61.3 mt -95.08 -24.78 4.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.914 171.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.3 t -133.6 149.64 51.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.2 m -78.39 59.73 2.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.932 -174.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 74' ' ' ARG . 13.8 ptt180 -169.28 -47.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.817 173.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.3 m -99.93 130.06 46.07 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.577 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.8 pt20 -149.66 153.9 37.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.749 0.309 . . . . 0.0 111.281 -174.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.466 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 93.2 m-85 -139.0 141.57 38.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.618 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.0 p -80.97 -10.8 59.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.617 0.246 . . . . 0.0 111.658 -174.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.5 m -132.29 138.48 47.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.643 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.11 -31.65 72.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.91 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -59.1 -48.64 80.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.611 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 82' ' ' GLN . 14.4 mm-40 -65.56 -40.72 93.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.647 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.559 HD13 ' N ' ' A' ' 84' ' ' VAL . 1.3 tm? -51.04 -57.98 7.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.615 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.559 ' N ' HD13 ' A' ' 83' ' ' LEU . 9.2 p -75.64 -42.44 41.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.515 -170.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.415 ' N ' HG13 ' A' ' 84' ' ' VAL . . . -59.22 -39.84 83.96 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.335 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -76.66 -42.99 39.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.854 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.544 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -74.86 -16.66 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -175.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.722 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 79.8 p -69.41 -14.57 62.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.795 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -113.2 -59.23 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.354 0.597 . . . . 0.0 109.543 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.695 ' HD2' ' HB2' ' A' ' 92' ' ' ASP . 6.5 t60 -98.84 95.33 7.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.796 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.85 -31.12 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 0.0 111.564 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.695 ' HB2' ' HD2' ' A' ' 90' ' ' HIS . 5.5 t70 53.3 -88.08 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.827 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -78.51 -43.62 12.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.408 -177.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.583 HD13 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -67.99 137.17 54.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.888 0.375 . . . . 0.0 110.81 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.72 -19.92 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.522 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.466 ' CE1' ' HD2' ' A' ' 26' ' ' ARG . 94.0 m-70 -120.03 139.51 52.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.455 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -74.76 134.21 41.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.669 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.722 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 84.9 mt -62.18 99.67 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.147 0.499 . . . . 0.0 109.783 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.7 m -84.73 -63.97 1.24 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.827 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.3 p30 -137.71 143.42 41.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.809 0.337 . . . . 0.0 110.22 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.665 HG12 ' HA ' ' A' ' 5' ' ' TRP . 1.9 t -88.3 132.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.4 t -65.4 128.35 93.72 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.58 147.09 35.39 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.491 2.127 . . . . 0.0 112.043 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.54 ' HB ' ' CE2' ' A' ' 7' ' ' PHE . 5.5 t -91.19 158.61 16.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 0.0 110.817 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.3 m -135.2 27.67 3.47 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.435 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.545 -0.74 . . . . 0.0 109.072 178.153 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 . . . . . 0 N--CA 1.484 1.233 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.89 74.8 0.36 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.637 0.586 . . . . 0.0 110.719 178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.717 ' HA ' ' HB3' ' A' ' 6' ' ' TYR . 20.9 mt-10 -127.89 -143.99 0.29 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.04 -174.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.583 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 30.2 mt-10 74.14 -47.94 0.65 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.829 0.852 . . . . 0.0 110.313 -171.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.438 ' HE3' HG13 ' A' ' 31' ' ' VAL . 1.4 p-90 -89.76 -32.99 16.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.717 ' HB3' ' HA ' ' A' ' 3' ' ' GLU . 3.1 t80 -80.09 94.31 5.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.826 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.527 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 35.4 m-85 -85.75 -13.08 49.4 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.922 0.392 . . . . 0.0 111.133 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.29 -153.51 29.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.645 176.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.494 ' CG ' ' HB2' ' A' ' 33' ' ' GLU . 30.4 mtmm -82.04 53.88 2.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.856 0.36 . . . . 0.0 111.819 -175.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.447 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 34.2 pt -77.5 140.89 16.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 173.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -70.14 163.67 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.46 ' HA ' ' NH1' ' A' ' 32' ' ' ARG . 13.4 ptp180 -57.29 -32.78 66.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.212 0.529 . . . . 0.0 110.153 176.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -60.84 -49.07 78.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.346 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -67.94 -57.35 6.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.32 -177.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.447 ' HB3' ' CD1' ' A' ' 10' ' ' ILE . 5.4 p -62.17 -52.39 64.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.864 -172.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.43 -29.21 61.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -172.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 17.0 tpt180 -69.09 -29.58 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.95 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.31 -43.21 86.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.48 ' HG ' ' HB2' ' A' ' 46' ' ' SER . 6.3 mp -74.8 -31.5 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.9 mm? -78.77 -7.68 58.03 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.098 0.406 . . . . 0.0 112.098 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.471 ' OD1' ' HD2' ' A' ' 22' ' ' PRO . 63.1 t30 -68.78 124.69 90.75 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.471 ' HD2' ' OD1' ' A' ' 21' ' ' ASN . 57.2 Cg_endo -70.46 46.68 0.61 Allowed 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 123.246 2.631 . . . . 0.0 114.553 -172.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -127.54 -4.66 5.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.102 0.477 . . . . 0.0 109.89 173.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -92.93 131.46 33.34 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.085 -176.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -86.31 162.64 9.82 Favored 'Trans proline' 0 C--O 1.239 0.559 0 C-N-CA 122.813 2.342 . . . . 0.0 111.776 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.587 ' HB2' ' HB2' ' A' ' 48' ' ' PHE . 3.2 ttm180 -60.96 117.87 6.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.18 -6.29 7.23 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.113 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.579 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 28.0 m -74.92 112.82 11.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 176.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CG ' HD22 ' A' ' 98' ' ' LEU . 34.5 p90 -125.68 161.34 27.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.987 0.422 . . . . 0.0 111.839 -174.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.527 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.2 pt? -159.99 138.2 10.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.401 171.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.438 HG13 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -98.97 114.76 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.463 0.649 . . . . 0.0 110.585 178.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.562 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 29.9 ptt180 -108.22 149.28 28.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.465 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.586 ' HG2' ' CE2' ' A' ' 41' ' ' TYR . 33.1 mt-10 -87.22 126.13 34.62 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 t -74.72 115.9 14.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.179 0.514 . . . . 0.0 110.103 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.29 -17.08 63.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.786 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.1 m -78.85 -34.76 44.79 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.281 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.7 m -136.67 113.56 10.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.957 0.408 . . . . 0.0 110.928 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -70.51 121.72 18.33 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.033 0.444 . . . . 0.0 110.638 -178.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.656 ' HA3' ' HD2' ' A' ' 63' ' ' LYS . . . 102.05 -4.86 52.66 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.016 -178.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.42 113.3 26.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.082 0.468 . . . . 0.0 110.169 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.756 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 69.1 m-85 -102.4 141.32 35.41 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.562 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 56.7 m -103.2 103.91 14.0 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 59' ' ' TYR . 2.4 tm? -79.67 86.9 5.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 172.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.2 m -84.81 114.78 22.33 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.001 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.92 136.55 50.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.938 0.399 . . . . 0.0 110.244 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.48 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 t -78.16 115.45 17.9 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.591 0.71 . . . . 0.0 109.2 172.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -110.25 136.85 48.8 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.445 -1.252 . . . . 0.0 108.982 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.587 ' HB2' ' HB2' ' A' ' 26' ' ' ARG . 56.6 t80 -82.02 126.38 31.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.985 0.421 . . . . 0.0 110.4 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -117.54 146.66 43.42 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.3 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.27 -13.9 56.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.839 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.26 -41.19 3.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.815 0.341 . . . . 0.0 110.792 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -85.91 -24.51 26.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.94 -73.14 1.99 Allowed Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -175.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.08 132.7 49.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -132.4 140.38 48.44 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 60.2 t -92.71 109.29 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.25 0.548 . . . . 0.0 110.347 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 57' ' ' LYS . 34.9 ttmt -92.26 105.21 17.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.74 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -86.6 107.93 18.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.063 -177.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.628 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 99.1 m-85 -86.11 121.79 29.21 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -83.49 109.77 17.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.615 0.721 . . . . 0.0 111.412 -177.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.756 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 72.0 mt -86.95 99.93 9.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.545 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -95.33 146.99 23.97 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.511 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HD2' ' HA3' ' A' ' 39' ' ' GLY . 0.1 OUTLIER -92.74 139.08 30.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.244 0.545 . . . . 0.0 109.914 177.623 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.433 HD12 ' NE2' ' A' ' 76' ' ' GLN . 13.9 mt -84.17 159.5 21.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.768 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -74.85 74.3 2.12 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.842 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.8 m 81.82 26.93 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.893 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.11 -38.87 1.46 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.877 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.423 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 145.39 -139.1 8.08 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 121.236 -0.506 . . . . 0.0 111.917 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -129.08 145.94 51.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -150.92 139.33 20.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.173 0.511 . . . . 0.0 111.507 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.498 HD12 ' CE2' ' A' ' 87' ' ' TYR . 33.0 mt -89.04 -30.37 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.913 0.864 . . . . 0.0 108.965 170.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -136.88 144.97 43.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.067 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.6 p -66.53 -11.04 50.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.238 -173.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -85.64 -20.7 29.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.041 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 m -135.69 112.27 10.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 0.0 111.327 -174.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.433 ' NE2' HD12 ' A' ' 64' ' ' LEU . 62.8 mt-30 -115.55 143.93 44.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.668 -176.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.421 ' HZ ' ' CD2' ' A' ' 86' ' ' TYR . 94.7 m-85 -126.97 162.73 25.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.116 177.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 t -86.72 -29.98 22.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.852 -0.158 . . . . 0.0 111.305 -177.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 88.3 p -143.81 167.77 21.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.619 0.247 . . . . 0.0 110.703 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 83' ' ' LEU . 2.6 mm? -65.47 -26.4 67.92 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.8 0.333 . . . . 0.0 111.161 177.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.32 -43.16 91.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.429 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -70.1 -31.0 68.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.534 HD11 ' CD2' ' A' ' 87' ' ' TYR . 2.2 tm? -55.78 -68.23 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.699 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -41.67 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -173.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.98 -27.89 47.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.039 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.421 ' CD2' ' HZ ' ' A' ' 77' ' ' PHE . 85.5 t80 -84.24 -52.39 6.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.85 178.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.534 ' CD2' HD11 ' A' ' 83' ' ' LEU . 22.5 m-85 -65.37 -15.91 63.06 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.629 -175.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.646 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.9 t -66.23 -32.02 73.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.007 0.432 . . . . 0.0 110.441 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.467 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 73.3 mmtt -113.59 -41.01 3.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.849 -176.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 13.1 m-70 -120.99 110.17 15.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -72.41 -39.25 68.07 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.98 -176.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 65.36 -75.52 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.628 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.79 -34.8 4.52 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.569 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -58.42 142.09 49.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.307 0.575 . . . . 0.0 111.238 176.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 20.7 m -74.45 -24.99 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.875 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -137.38 147.95 45.87 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.664 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.467 ' HD2' ' O ' ' A' ' 89' ' ' LYS . 40.3 mtm180 -84.71 135.77 34.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.037 -177.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 81.7 mt -55.8 110.35 0.71 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.905 0.384 . . . . 0.0 110.537 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -94.92 -63.25 1.19 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.386 -174.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -134.74 146.93 49.87 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.5 t -83.37 153.39 3.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.014 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.3 t -59.28 136.52 88.56 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.668 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.7 Cg_exo -65.68 146.11 83.2 Favored 'Trans proline' 0 C--N 1.347 0.447 0 C-N-CA 123.012 2.474 . . . . 0.0 111.553 175.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 p -89.73 164.05 14.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.667 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 63.0 m 60.98 98.41 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.252 0.621 . . . . 0.0 112.278 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttm . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.33 -0.843 . . . . 0.0 109.999 177.64 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.671 0.272 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.34 62.73 0.55 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -91.58 -175.42 4.19 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.751 -172.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -57.27 -52.67 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.04 0.448 . . . . 0.0 110.434 174.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -71.61 -35.97 70.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.946 -177.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.434 ' HA ' HG13 ' A' ' 31' ' ' VAL . 39.3 t80 -89.41 101.06 13.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.889 0.376 . . . . 0.0 110.793 -176.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.462 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 15.5 m-85 -84.37 -33.62 23.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.369 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 124.83 -166.8 17.36 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.321 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.817 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 14.1 pttp -89.5 59.28 4.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.877 0.846 . . . . 0.0 111.229 -178.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.1 pt -76.42 149.21 6.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.671 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 47.2 p -82.35 167.75 18.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -61.84 -38.55 88.62 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.621 -177.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -41.29 68.6 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.232 0.539 . . . . 0.0 110.694 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -78.49 -47.59 17.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.491 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -61.35 -48.43 81.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.477 -176.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.62 -32.37 69.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.021 -176.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -60.05 -30.57 69.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.95 -40.39 28.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.095 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.453 HD22 HD23 ' A' ' 30' ' ' LEU . 74.5 mt -81.96 -23.11 36.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 20' ' ' LEU . 3.8 mm? -85.22 42.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.338 0.589 . . . . 0.0 111.261 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -104.62 128.78 26.19 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 169.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.551 ' HA ' HD12 ' A' ' 54' ' ' LEU . 11.9 Cg_endo -55.23 -22.15 31.43 Favored 'Trans proline' 0 N--CA 1.473 0.306 0 C-N-CA 123.495 2.797 . . . . 0.0 114.549 -170.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -98.74 23.75 8.39 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.852 -177.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -78.17 115.46 51.03 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 120.853 0.359 . . . . 0.0 110.045 173.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.434 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 21.5 Cg_exo -65.35 154.32 74.16 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.907 2.405 . . . . 0.0 111.956 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -66.16 109.1 2.49 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.484 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.91 22.55 5.62 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.544 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 61.5 m -83.73 124.38 30.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 175.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.458 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 29.5 p90 -133.29 161.62 34.0 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.462 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.1 pt? -160.92 138.23 9.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.788 170.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.453 ' HB ' HD21 ' A' ' 43' ' ' LEU . 2.1 p -103.47 118.91 51.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.666 0.746 . . . . 0.0 110.855 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 19.0 ptt85 -112.67 148.81 33.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.443 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.817 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 35.0 tt0 -83.93 134.99 34.64 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 37' ' ' THR . 38.0 m -73.75 130.06 39.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.434 0.635 . . . . 0.0 111.565 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -79.36 -18.7 51.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.488 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.2 p -119.89 9.22 11.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.515 ' O ' ' HB2' ' A' ' 34' ' ' SER . 78.9 m -153.79 124.63 7.25 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.758 0.313 . . . . 0.0 110.653 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -103.64 138.87 39.7 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.789 0.328 . . . . 0.0 110.131 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.31 9.38 56.88 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -175.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -150.44 120.75 7.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.938 0.399 . . . . 0.0 110.392 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.488 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 57.0 m-85 -101.3 165.01 11.5 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.414 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 32.4 t -117.47 111.64 19.56 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.744 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.453 HD21 ' HB ' ' A' ' 31' ' ' VAL . 2.3 tm? -90.71 87.03 6.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.4 m -78.28 122.09 25.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.869 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 p -118.67 138.43 49.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.96 0.41 . . . . 0.0 110.331 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -94.19 128.96 40.93 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.604 0.716 . . . . 0.0 110.063 179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -112.16 133.23 54.42 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.519 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -105.97 112.52 25.61 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.457 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -118.59 147.74 43.4 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.469 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -79.58 -13.36 59.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.719 -174.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.21 -44.0 2.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 111.246 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -81.4 -20.59 40.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.064 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 85.94 -133.11 11.55 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.98 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 22' ' ' PRO . 95.0 mt -96.84 109.65 22.31 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.146 0.498 . . . . 0.0 110.284 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -105.87 116.52 32.08 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.009 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 82.7 t -91.62 107.8 19.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.151 0.5 . . . . 0.0 109.937 178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -95.31 114.52 26.31 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.216 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -89.56 87.11 6.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.537 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.433 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 76.8 m-85 -76.46 157.38 32.25 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -123.04 120.6 33.81 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.22 0.533 . . . . 0.0 111.51 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.584 HG12 HG12 ' A' ' 71' ' ' ILE . 52.8 mt -89.8 88.24 2.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.782 176.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -93.71 154.46 17.78 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.504 -174.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 21.4 pttp -109.8 142.6 40.83 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.105 0.479 . . . . 0.0 110.214 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.479 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 45.2 mt -78.97 175.01 10.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.801 177.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -62.06 -46.27 89.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.705 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.9 t -153.28 58.71 0.77 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -140.59 -33.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.839 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.403 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 121.73 -158.97 16.41 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.248 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.67 147.84 25.54 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.448 0.299 . . . . 0.0 110.389 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.479 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 44.9 p90 -156.04 143.23 19.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.602 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.676 HG23 HD12 ' A' ' 94' ' ' LEU . 62.0 mt -83.86 -29.78 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.578 0.704 . . . . 0.0 109.134 173.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.414 HG21 ' HA3' ' A' ' 93' ' ' GLY . 11.5 t -146.12 161.06 41.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.472 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.8 p -78.07 59.34 2.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.986 0.422 . . . . 0.0 111.304 -177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -132.04 -78.98 0.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.37 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.8 m -100.67 122.42 43.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.335 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -104.17 147.11 27.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.262 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.587 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 95.9 m-85 -132.02 142.25 49.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 121.343 0.592 . . . . 0.0 111.391 -178.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -72.67 -21.3 61.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.517 -177.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.1 p -141.34 172.66 12.37 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.82 0.343 . . . . 0.0 111.231 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 85.7 mt -79.52 -28.19 41.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.712 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -64.9 -43.7 92.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -60.76 -36.76 79.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.393 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.65 HD22 HG13 ' A' ' 71' ' ' ILE . 3.2 tm? -55.75 -67.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.564 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -41.47 92.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -175.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.94 -34.92 66.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.79 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.976 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.753 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 34.9 m-85 -70.93 -7.75 48.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.373 -176.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.585 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.9 t -71.31 -23.04 61.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.188 0.518 . . . . 0.0 110.08 173.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -116.05 -45.75 2.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.177 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.753 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 24.9 m-70 -111.06 116.67 31.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.049 177.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.58 -24.51 64.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.514 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 35.3 t70 62.63 -81.8 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.612 0.765 . . . . 0.0 112.072 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.414 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -101.53 -33.26 4.85 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.743 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.676 HD12 HG23 ' A' ' 71' ' ' ILE . 4.0 mp -71.0 171.05 11.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.052 0.453 . . . . 0.0 110.329 175.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . 0.559 ' HG ' ' CE1' ' A' ' 96' ' ' HIS . 5.5 p -114.3 12.74 17.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.455 0.645 . . . . 0.0 109.514 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.559 ' CE1' ' HG ' ' A' ' 95' ' ' CYS . 79.2 m80 -128.26 118.15 22.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.001 -0.999 . . . . 0.0 109.756 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -75.66 133.6 40.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 176.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 64.8 mt -66.49 88.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.4 m -88.49 -57.5 2.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.439 -171.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.5 p-10 -130.64 145.2 51.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.824 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.88 158.4 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.842 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.3 t -56.4 133.64 76.48 Favored Pre-proline 0 C--N 1.327 -0.396 0 O-C-N 123.498 0.499 . . . . 0.0 111.292 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.34 154.56 56.17 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.697 2.265 . . . . 0.0 112.019 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.1 p -94.8 165.48 12.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.513 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.3 t -95.77 119.83 34.96 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -177.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.429 ' HB3' ' HE2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.751 -0.642 . . . . 0.0 110.026 -178.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.4 tm0? . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 120.896 0.379 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.27 135.42 14.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.059 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -68.62 146.62 52.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.299 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.04 -50.11 28.96 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 123.62 0.575 . . . . 0.0 112.101 -172.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.481 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 4.6 p-90 -77.94 -31.23 50.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.358 -174.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.481 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 63.4 t80 -91.11 106.33 18.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.789 0.328 . . . . 0.0 111.082 -174.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.521 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 43.8 m-85 -94.55 15.32 18.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.511 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.472 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 81.79 -131.09 10.14 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.552 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -122.54 115.73 22.68 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.671 0.748 . . . . 0.0 110.033 176.59 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.541 ' HB ' ' HB2' ' A' ' 14' ' ' GLU . 35.1 pt -131.85 154.08 39.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.045 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.7 p -96.9 179.85 4.81 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.549 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 12' ' ' ARG . 8.2 ptm180 -54.51 -32.04 57.3 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.191 0.307 . . . . 0.0 111.232 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 59.9 ttp180 -59.72 -51.79 68.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.902 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.541 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 11.8 mp0 -72.68 -45.81 57.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.934 0.397 . . . . 0.0 110.458 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.9 t -59.73 -66.87 0.45 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.959 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.06 -23.1 65.2 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -177.495 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -62.66 -42.44 99.62 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.2 0.524 . . . . 0.0 109.963 178.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.8 mt -80.89 -39.57 26.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.878 -177.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.546 HD13 HD21 ' A' ' 30' ' ' LEU . 62.4 mt -79.45 -35.22 40.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.267 -172.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 3.9 mm? -83.21 14.18 3.68 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.177 0.513 . . . . 0.0 110.524 177.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -92.82 107.19 22.61 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 172.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -72.63 49.17 1.44 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.327 2.685 . . . . 0.0 114.416 -169.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -119.63 4.72 11.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.345 0.593 . . . . 0.0 109.839 172.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -104.59 144.25 28.33 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.339 -178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -84.61 168.7 11.11 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 123.156 2.571 . . . . 0.0 112.054 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -63.96 129.23 39.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.949 0.404 . . . . 0.0 110.834 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.19 3.67 31.24 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.213 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 85.4 m -72.33 109.15 5.86 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.902 -0.406 . . . . 0.0 109.902 175.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.427 ' CG ' HD21 ' A' ' 98' ' ' LEU . 32.5 p90 -126.83 161.31 28.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 111.621 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.546 HD21 HD13 ' A' ' 19' ' ' LEU . 2.1 pt? -160.59 143.64 13.26 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG11 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -107.78 122.13 61.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.69 0.757 . . . . 0.0 110.905 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 16.1 ptt180 -117.19 142.07 47.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.228 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -81.92 121.5 26.57 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.733 ' HB2' HG21 ' A' ' 37' ' ' THR . 4.2 m -77.54 113.15 15.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.686 0.279 . . . . 0.0 110.304 -177.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -70.54 -3.83 19.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.862 0.363 . . . . 0.0 111.477 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.7 t -95.63 9.19 41.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.139 0.495 . . . . 0.0 110.7 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.897 HG22 ' HB1' ' A' ' 40' ' ' ALA . 11.1 t -150.14 169.78 20.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.734 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -123.67 30.08 6.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.558 0.694 . . . . 0.0 110.736 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.432 ' HA2' ' HE2' ' A' ' 63' ' ' LYS . . . 171.2 44.18 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.801 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.897 ' HB1' HG22 ' A' ' 37' ' ' THR . . . -152.34 101.44 2.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.146 0.498 . . . . 0.0 110.614 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.693 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 41.9 m-85 -90.71 149.37 22.08 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.82 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.0 m -108.92 106.48 16.48 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.694 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.444 ' HB2' HD12 ' A' ' 61' ' ' ILE . 1.6 tm? -84.41 88.2 7.27 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.416 ' HG ' ' CE1' ' A' ' 58' ' ' HIS . 15.1 m -85.5 108.75 18.07 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.357 -176.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.2 p -107.89 124.56 64.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.336 0.589 . . . . 0.0 110.653 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.6 t -79.39 129.81 34.82 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.138 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.34 115.65 13.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.136 -176.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -83.45 83.97 7.69 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 170.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -71.21 110.31 5.78 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.03 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -74.19 73.65 1.77 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.203 0.525 . . . . 0.0 110.552 -172.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.82 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.938 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -121.93 -34.57 3.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.709 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.77 -148.45 16.86 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.648 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -75.51 114.93 14.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.0 111.67 -177.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -126.13 117.39 23.04 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 91.9 t -88.93 106.2 16.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -84.23 102.26 12.5 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.12 -175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.416 ' CE1' ' HG ' ' A' ' 44' ' ' SER . 15.2 m-70 -80.98 93.89 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.914 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.651 ' HB3' HG21 ' A' ' 71' ' ' ILE . 57.4 m-85 -77.13 124.62 28.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.119 0.485 . . . . 0.0 110.025 177.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -88.23 110.9 21.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.07 -170.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.693 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 54.4 mt -91.45 94.25 4.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.793 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -92.01 157.07 16.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.745 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HE2' ' HA2' ' A' ' 39' ' ' GLY . 43.5 mtmt -97.88 147.23 24.65 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.624 0.726 . . . . 0.0 112.168 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.458 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 87.1 mt -115.84 130.55 56.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.332 -1.303 . . . . 0.0 109.212 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -72.54 -22.6 60.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.938 0.399 . . . . 0.0 110.482 -178.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 p -113.89 30.97 6.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.789 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.41 -94.08 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.325 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.458 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 173.52 -134.01 2.77 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.828 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -99.26 137.02 38.36 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' O ' ' HA ' ' A' ' 61' ' ' ILE . 25.8 p90 -144.11 140.46 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.167 0.508 . . . . 0.0 110.839 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.668 HG12 HG12 ' A' ' 61' ' ' ILE . 59.2 mt -87.0 -35.37 8.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.781 174.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.2 t -143.63 159.75 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.452 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -75.88 57.28 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.507 0.67 . . . . 0.0 110.739 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -130.74 -64.45 0.83 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.773 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.2 m -134.47 123.01 23.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.698 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.29 144.06 44.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.679 0.276 . . . . 0.0 110.831 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -127.62 147.3 50.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 p -83.35 10.5 8.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.126 0.489 . . . . 0.0 111.125 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.0 m -148.65 135.23 19.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.773 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.623 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.9 mt -63.25 -35.2 79.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.647 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -61.73 -46.06 91.26 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.713 0.292 . . . . 0.0 110.819 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -61.34 -38.63 87.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.821 178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD12 HD12 ' A' ' 71' ' ' ILE . 3.2 tm? -58.42 -64.14 1.03 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.994 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.9 m -63.51 -45.31 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.61 -33.64 68.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -78.12 -46.3 21.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.832 0.349 . . . . 0.0 110.462 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.603 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-85 -73.11 -7.33 50.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.442 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.6 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 28.0 t -74.67 -15.92 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.281 0.562 . . . . 0.0 109.851 174.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -120.58 -51.42 2.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.626 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.603 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.0 t-80 -103.4 107.06 17.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.76 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 66.92 -65.48 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.071 0.548 . . . . 0.0 112.458 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -125.6 -30.93 0.86 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.952 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.565 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.3 mp -64.92 148.28 51.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.281 0.562 . . . . 0.0 111.183 178.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 62.2 m -78.4 -6.97 56.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.933 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -152.71 144.33 23.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -67.62 145.62 54.67 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.91 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.6 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 87.5 mt -64.79 95.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.7 m -90.34 -60.5 1.91 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.754 -171.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.8 p-10 -131.66 141.19 49.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -176.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -80.87 149.95 4.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.439 ' HA ' HG22 ' A' ' 28' ' ' THR . 51.7 t -56.7 117.95 20.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -75.18 147.37 33.17 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.912 2.408 . . . . 0.0 110.712 173.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 t -159.44 169.46 23.87 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.167 0.508 . . . . 0.0 110.793 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.2 t -166.72 155.16 10.22 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.133 -177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.753 0.311 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 6' ' ' TYR . . . -126.53 108.39 11.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.18 179.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 58.75 -170.0 0.12 Allowed 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.6 0.563 . . . . 0.0 111.821 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -98.89 -54.99 2.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.273 0.558 . . . . 0.0 110.063 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' HE3' ' CG1' ' A' ' 31' ' ' VAL . 5.3 p-90 -68.6 -28.73 67.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.854 -176.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.523 ' HB3' ' O ' ' A' ' 2' ' ' ALA . 23.9 t80 -80.89 125.93 30.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.199 -178.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.573 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 16.9 m-85 -118.62 34.6 5.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.043 0.449 . . . . 0.0 111.9 -178.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.5 -141.52 35.43 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.934 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.66 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 33.0 mtmm -117.98 48.34 1.41 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.74 0.305 . . . . 0.0 111.22 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 pt -67.81 151.32 10.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.56 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.3 p -80.62 172.46 13.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.203 -178.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -59.77 -48.22 82.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 110.283 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.8 -47.5 77.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.137 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.2 -41.13 97.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.931 0.396 . . . . 0.0 110.826 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 22.7 t -62.95 -48.15 80.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.283 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.661 ' HB3' HD23 ' A' ' 20' ' ' LEU . 61.3 mt-10 -69.74 -27.91 65.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.357 -178.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -60.74 -30.19 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.224 0.535 . . . . 0.0 110.374 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.14 -28.49 18.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.469 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.538 HD21 HD23 ' A' ' 30' ' ' LEU . 83.3 mt -93.83 -34.23 13.24 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.661 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.1 mm? -79.17 49.43 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.481 0.658 . . . . 0.0 111.179 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.402 ' C ' ' H ' ' A' ' 23' ' ' GLU . 92.3 m-20 -125.23 112.81 26.18 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.426 ' HA ' HD22 ' A' ' 54' ' ' LEU . 57.8 Cg_endo -71.82 41.76 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.998 2.465 . . . . 0.0 113.326 -175.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 21' ' ' ASN . 36.7 mt-10 -128.45 9.44 6.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.931 177.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -110.5 149.88 40.87 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.681 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -82.92 157.68 15.62 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.81 2.34 . . . . 0.0 112.158 176.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -62.94 140.07 58.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 120.898 0.38 . . . . 0.0 110.396 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.97 2.43 59.43 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.39 -0.909 . . . . 0.0 111.667 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.704 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 65.3 m -73.2 110.79 7.76 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.576 ' CG ' HD22 ' A' ' 98' ' ' LEU . 27.0 p90 -127.35 158.07 38.24 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.124 0.487 . . . . 0.0 111.586 -172.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.573 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.6 pt? -152.24 132.86 13.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.504 170.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.439 ' CG1' ' HE3' ' A' ' 5' ' ' TRP . 2.6 p -103.1 114.27 42.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.964 -177.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.498 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 24.4 ptt85 -109.1 144.16 37.5 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.07 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.66 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 36.6 tt0 -83.36 138.21 33.62 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.131 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 45.4 t -88.01 138.15 31.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.336 0.589 . . . . 0.0 111.686 -175.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -93.34 -15.85 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.307 175.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.3 p -98.96 -5.56 30.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -173.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 40' ' ' ALA . 17.6 m -148.69 131.63 16.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.714 0.292 . . . . 0.0 110.734 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.98 121.33 26.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.47 -178.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.72 31.23 36.87 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.143 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -130.45 128.84 42.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.92 0.39 . . . . 0.0 110.241 178.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -119.86 147.67 44.41 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.81 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.498 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 35.4 m -105.15 94.75 5.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.529 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.695 ' HB2' HD13 ' A' ' 61' ' ' ILE . 1.7 tm? -77.93 88.86 4.1 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 174.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.6 m -87.27 114.84 24.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.488 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -120.25 141.2 41.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.086 0.469 . . . . 0.0 111.124 -176.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.0 t -84.15 129.36 34.9 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.801 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 25.5 t0 -123.61 61.12 1.07 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.435 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.71 111.44 3.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.381 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.511 ' OD2' ' HG2' ' A' ' 52' ' ' LYS . 9.9 t70 -114.97 144.12 44.09 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.448 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -75.06 -12.44 60.32 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.927 -170.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -104.27 -44.22 5.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.856 0.36 . . . . 0.0 111.304 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.814 ' HG3' HD22 ' A' ' 55' ' ' ASN . 6.6 ptpp? -101.19 -9.0 21.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.19 0.519 . . . . 0.0 111.575 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.49 -148.71 19.73 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.544 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 22' ' ' PRO . 86.0 mt -80.73 114.6 19.73 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.41 0.284 . . . . 0.0 111.129 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.814 HD22 ' HG3' ' A' ' 52' ' ' LYS . 13.4 m-80 -115.13 124.05 50.52 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.626 HG21 HD21 ' A' ' 20' ' ' LEU . 79.8 t -111.59 114.66 47.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.211 0.529 . . . . 0.0 110.373 177.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -97.81 105.59 17.76 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.106 -176.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -81.61 83.9 6.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -67.34 127.07 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.29 0.567 . . . . 0.0 111.864 -176.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -82.04 96.1 7.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.485 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.695 HD13 ' HB2' ' A' ' 43' ' ' LEU . 58.6 mt -74.92 97.72 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 175.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -91.4 137.8 32.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.383 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -91.83 151.57 20.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.253 0.549 . . . . 0.0 109.983 174.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.43 157.51 20.46 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 168.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -51.32 -44.08 61.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.3 m -67.51 -26.84 66.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 123.02 42.74 0.39 Allowed Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.37 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.61 108.66 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.917 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -84.97 130.13 34.68 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -143.12 143.25 31.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.394 0.616 . . . . 0.0 111.306 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.67 HG12 HG12 ' A' ' 61' ' ' ILE . 70.8 mt -92.4 -39.44 11.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.47 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.8 t -114.78 147.89 39.15 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.813 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.0 p -67.81 -7.24 26.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 74' ' ' ARG . 63.7 mtt180 -83.74 -57.61 3.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.904 0.383 . . . . 0.0 110.812 178.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.405 HG21 ' CD2' ' A' ' 86' ' ' TYR . 1.3 m -101.68 104.82 15.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.812 -171.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -113.96 133.87 55.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.668 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.492 ' CD2' ' HA ' ' A' ' 83' ' ' LEU . 83.8 m-85 -124.49 146.6 48.87 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.2 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.4 t -88.23 -2.39 58.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 45.5 m -144.03 137.35 27.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.054 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.525 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.9 mt -65.38 -23.46 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -56.52 -47.72 78.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.297 0.57 . . . . 0.0 110.204 174.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -73.36 -27.2 61.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.638 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.492 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 3.4 tm? -59.12 -64.74 0.83 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.262 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.25 -44.31 97.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.755 -176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.76 -42.27 62.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.032 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.405 ' CD2' HG21 ' A' ' 75' ' ' THR . 91.2 t80 -78.14 -43.05 29.91 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.63 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -69.84 -12.34 61.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.665 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.47 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 50.0 m -72.63 -22.36 60.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.274 0.559 . . . . 0.0 110.096 173.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -104.59 -44.47 4.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.643 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.63 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 31.6 m-70 -125.5 114.81 19.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.623 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -76.39 -40.71 50.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.69 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.47 ' HB3' HG21 ' A' ' 72' ' ' THR . 12.2 t70 65.42 -76.32 0.04 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.732 177.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.03 -40.42 8.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.209 -0.52 . . . . 0.0 112.156 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.623 ' HB2' ' HB3' ' A' ' 91' ' ' ALA . 4.5 mp -67.4 150.15 49.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.061 0.457 . . . . 0.0 110.47 178.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 32.6 t -72.68 -18.03 61.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.558 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -149.79 139.68 21.89 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.593 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 32.7 ptt85 -73.58 158.18 35.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.093 0.473 . . . . 0.0 111.515 -176.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.576 HD22 ' CG ' ' A' ' 29' ' ' PHE . 59.6 mt -66.52 101.3 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.062 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.8 m -97.65 -41.5 8.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.636 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.704 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.0 t30 -141.65 132.74 26.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.026 0.441 . . . . 0.0 110.511 -175.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.4 t -81.06 139.39 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.447 ' HA ' HG21 ' A' ' 28' ' ' THR . 51.0 t -53.65 118.76 15.82 Favored Pre-proline 0 C--N 1.33 -0.251 0 O-C-N 123.507 0.504 . . . . 0.0 111.135 -176.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.73 151.96 46.98 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.469 2.113 . . . . 0.0 111.558 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 t -73.61 144.51 45.94 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.943 0.401 . . . . 0.0 110.07 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.1 t -142.5 121.08 12.51 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.095 -171.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 C--O 1.244 0.797 0 CA-C-O 118.637 -0.697 . . . . 0.0 109.758 174.758 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.1 157.63 11.53 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.917 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -80.15 160.35 25.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.43 -28.51 13.18 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.538 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.736 ' HA ' HG12 ' A' ' 101' ' ' VAL . 15.3 p-90 -82.03 -28.72 32.35 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.435 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -99.59 110.15 22.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.118 0.485 . . . . 0.0 110.612 -174.668 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -98.94 -0.9 41.27 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.0 -156.6 23.75 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.193 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -86.47 61.35 6.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.396 0.617 . . . . 0.0 111.547 -177.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.53 HD11 HD11 ' A' ' 30' ' ' LEU . 46.3 pt -74.47 138.0 21.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 174.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.6 p -72.94 159.73 33.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' A' ' 15' ' ' SER . 10.2 ptm180 -67.2 -23.54 65.75 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.883 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 23.2 tpt180 -61.89 -39.0 90.43 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.96 -35.42 64.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.791 176.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.496 ' HB3' ' HA ' ' A' ' 12' ' ' ARG . 29.0 t -60.52 -67.21 0.42 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.981 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -54.48 -38.85 66.9 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.739 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -57.15 -39.46 75.27 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -177.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.0 mt -86.6 -34.89 19.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.6 mt -81.07 -17.96 48.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.215 -174.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.54 14.08 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.591 0.234 . . . . 0.0 111.567 177.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.563 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 21.5 t30 -67.77 120.14 71.45 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -57.35 -20.78 41.35 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.043 2.495 . . . . 0.0 113.302 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -98.47 21.1 11.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.858 0.361 . . . . 0.0 111.472 -178.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.563 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 94.5 m-20 -89.82 118.21 68.76 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 170.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.91 144.3 64.02 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.152 1.901 . . . . 0.0 111.489 175.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.445 ' HB2' ' HB3' ' A' ' 48' ' ' PHE . 41.0 ttp180 -56.41 110.68 0.81 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.109 177.349 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.16 -0.6 7.08 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.644 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 37.1 m -77.36 129.05 35.31 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.564 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 28.6 p90 -139.39 171.25 14.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.151 0.5 . . . . 0.0 111.959 -173.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.53 HD11 HD11 ' A' ' 10' ' ' ILE . 3.4 pp -158.17 149.2 20.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.513 166.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.507 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.07 120.65 59.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.746 0.784 . . . . 0.0 110.814 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.643 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.8 145.95 37.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.279 -179.324 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -89.63 131.89 35.4 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.319 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.8 t -104.64 107.71 18.79 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -75.66 -3.04 32.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.965 0.412 . . . . 0.0 111.315 -173.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -42.64 87.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.33 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.445 ' HB ' ' HB1' ' A' ' 40' ' ' ALA . 29.6 m -121.19 127.55 51.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.356 -177.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -79.12 74.26 5.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.419 0.628 . . . . 0.0 110.366 -177.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.515 ' HA2' ' HE3' ' A' ' 63' ' ' LYS . . . 139.52 27.08 0.25 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.202 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.445 ' HB1' ' HB ' ' A' ' 37' ' ' THR . . . -138.86 97.65 3.37 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.174 0.511 . . . . 0.0 110.457 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.751 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.7 m-85 -90.7 169.81 10.67 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.643 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -128.55 110.56 12.38 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.549 ' HB2' HD13 ' A' ' 61' ' ' ILE . 2.6 tm? -89.68 93.52 9.5 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 175.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 38.0 m -84.49 105.42 15.29 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -104.4 135.03 44.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 t -75.89 125.59 29.39 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.534 0.683 . . . . 0.0 110.467 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -105.94 133.04 51.29 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.173 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 53' ' ' GLY . 55.7 t80 -141.73 114.6 8.57 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.761 0.791 . . . . 0.0 112.679 -171.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.876 ' HB3' ' HA3' ' A' ' 53' ' ' GLY . 0.6 OUTLIER -84.75 142.31 29.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.862 165.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -58.91 -12.73 4.84 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -166.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -129.02 -54.32 1.2 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -117.85 -11.18 10.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -166.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.876 ' HA3' ' HB3' ' A' ' 49' ' ' ASP . . . -102.42 58.26 0.59 Allowed Glycine 0 C--O 1.225 -0.411 0 C-N-CA 119.807 -1.187 . . . . 0.0 115.394 -163.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.419 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 12.5 mt -90.47 131.4 36.24 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.932 0.866 . . . . 0.0 110.538 171.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.557 ' N ' HD21 ' A' ' 55' ' ' ASN . 0.1 OUTLIER -175.85 166.89 3.1 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.626 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.8 t -102.92 125.24 57.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 120.773 0.321 . . . . 0.0 110.176 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -99.22 101.44 12.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -82.19 104.06 12.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.334 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -91.37 136.68 32.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.872 173.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -93.51 127.49 39.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.182 0.515 . . . . 0.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.751 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.6 mt -93.5 101.41 12.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.259 177.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.2 142.79 27.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.831 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.515 ' HE3' ' HA2' ' A' ' 39' ' ' GLY . 26.0 ttpp -108.75 128.57 54.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.614 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.8 mt -75.81 150.69 37.65 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.876 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -53.06 -54.7 31.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.053 0.454 . . . . 0.0 111.406 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -129.87 45.69 2.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.208 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 -107.21 0.74 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.202 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -152.83 -151.11 5.59 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.778 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -110.15 141.82 42.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.73 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 46.4 p90 -147.38 137.59 23.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.161 0.505 . . . . 0.0 110.923 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.467 HG12 HG12 ' A' ' 61' ' ' ILE . 75.2 mt -84.65 -52.56 12.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -103.81 146.8 28.1 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.545 171.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.5 t -81.74 47.91 1.14 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.238 0.542 . . . . 0.0 111.02 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 73.3 mtp180 -135.37 -57.73 0.79 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.918 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 31.0 m -105.23 116.79 32.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.73 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.4 pt20 -133.73 148.51 51.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.259 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.519 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 96.1 m-85 -131.79 143.38 50.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.161 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.5 m -75.56 -5.1 43.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.5 m -140.88 144.12 35.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.248 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.513 ' O ' HG23 ' A' ' 84' ' ' VAL . 69.6 mt -68.26 -27.27 66.19 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.112 -176.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -54.28 48.9 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -59.38 -33.33 71.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.309 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.51 -65.24 0.69 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.47 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.83 -44.92 96.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -175.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.32 -43.65 83.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.033 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -76.26 -36.18 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.416 -177.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 8.4 m-85 -79.88 0.18 32.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.92 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.583 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 50.2 m -67.64 -29.74 69.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.48 0.657 . . . . 0.0 109.47 173.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -115.72 -43.22 3.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.984 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.559 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 73.1 m80 -94.97 90.88 6.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.308 -178.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.692 ' HB1' ' HG3' ' A' ' 97' ' ' ARG . . . -66.12 -35.57 80.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.884 0.373 . . . . 0.0 110.195 177.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.86 -83.99 0.02 OUTLIER 'General case' 0 C--O 1.235 0.292 0 CA-C-N 114.788 -1.097 . . . . 0.0 111.908 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.24 -42.75 4.84 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.993 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.558 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -60.81 153.02 25.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.056 0.455 . . . . 0.0 110.964 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . 0.437 ' HG ' ' CD2' ' A' ' 96' ' ' HIS . 25.3 p -88.13 -10.07 51.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.161 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.437 ' CD2' ' HG ' ' A' ' 95' ' ' CYS . 82.3 m-70 -121.65 149.99 42.39 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.661 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.692 ' HG3' ' HB1' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -105.84 137.6 43.45 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.093 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.8 mt -68.62 87.17 0.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.175 0.512 . . . . 0.0 110.706 -177.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.7 m -80.41 -48.58 12.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.548 -173.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -155.24 152.71 29.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.791 0.329 . . . . 0.0 110.26 -178.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.736 HG12 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -91.52 140.35 16.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.996 -176.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.94 125.49 92.01 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.275 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.99 159.27 44.95 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.796 2.331 . . . . 0.0 111.683 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p -63.02 -20.65 65.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.913 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 10.6 m 62.14 83.84 0.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.26 0.553 . . . . 0.0 110.519 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.337 -0.84 . . . . 0.0 110.395 -175.706 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.91 0.386 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.72 172.06 13.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 175.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.16 118.3 5.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.4 0.619 . . . . 0.0 109.727 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -54.9 -43.98 73.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.613 -168.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -76.56 -38.49 54.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -86.34 107.21 17.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 0.0 111.053 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.474 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 27.1 m-85 -97.88 14.41 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.361 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.02 -143.42 28.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.763 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -111.17 51.6 0.77 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.138 0.494 . . . . 0.0 111.26 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 pt -61.73 147.17 11.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.057 175.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.7 p -87.82 -175.96 5.33 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.587 -177.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -39.51 94.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.97 0.414 . . . . 0.0 110.7 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -55.07 -48.22 73.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.321 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.66 -55.31 15.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.552 -176.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.9 p -61.36 -56.76 16.74 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -172.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HB3' HD23 ' A' ' 20' ' ' LEU . 1.6 mp0 -66.62 -29.25 69.24 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -176.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -66.46 -25.26 66.64 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.935 -0.478 . . . . 0.0 110.481 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.7 mt -85.52 -38.75 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.97 0.414 . . . . 0.0 110.794 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.412 HD11 HD21 ' A' ' 30' ' ' LEU . 81.7 mt -82.06 -28.67 32.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.162 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.417 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.0 mm? -78.89 52.35 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.997 0.427 . . . . 0.0 111.442 178.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.432 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 51.3 m-80 -136.33 132.02 18.78 Favored Pre-proline 0 C--N 1.32 -0.713 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 15.3 Cg_exo -69.41 7.67 0.85 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.303 2.669 . . . . 0.0 112.4 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 21' ' ' ASN . 25.5 mt-10 -94.36 -1.0 54.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.053 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -97.21 129.18 32.73 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.09 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.525 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 15.2 Cg_exo -66.24 138.68 52.21 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.279 1.986 . . . . 0.0 111.087 173.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -61.79 101.31 0.19 Allowed 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.85 -3.12 3.42 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.505 -171.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.546 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 89.1 m -69.77 117.47 11.41 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 122.452 0.301 . . . . 0.0 110.457 175.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.539 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 36.5 p90 -123.98 164.68 18.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.067 0.46 . . . . 0.0 111.821 -175.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.474 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.9 pt? -164.22 146.02 8.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.709 173.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -112.94 120.18 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.52 0.676 . . . . 0.0 111.347 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.499 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 27.4 ptt180 -107.17 150.98 26.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.169 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -92.45 142.59 27.26 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 175.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.2 t -72.36 123.54 23.26 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -76.88 -15.25 59.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.909 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -101.09 -21.78 14.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.906 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 23.8 m -130.23 121.0 25.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.059 0.457 . . . . 0.0 111.479 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -85.25 115.4 23.0 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 1.02 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 115.1 11.74 10.61 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.603 -175.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.03 129.16 23.68 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.006 0.431 . . . . 0.0 110.493 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.756 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 88.4 m-85 -120.25 179.67 4.22 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.499 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 61.5 m -139.09 100.11 3.94 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.688 0.28 . . . . 0.0 110.332 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.8 tm? -82.94 95.96 8.15 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 174.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.5 t -93.19 143.09 26.59 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.91 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.8 p -136.05 133.01 50.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.155 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -80.14 126.61 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.592 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.52 147.59 50.7 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.792 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -133.34 113.66 12.84 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.335 0.588 . . . . 0.0 110.698 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.517 ' HB3' ' HD3' ' A' ' 52' ' ' LYS . 11.6 m-20 -105.8 137.99 42.75 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.84 173.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -71.4 -9.13 57.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.353 -173.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.17 -21.59 9.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.517 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -103.2 -23.8 13.6 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.858 0.361 . . . . 0.0 111.315 -177.106 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.05 23.09 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.69 114.79 17.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.928 0.394 . . . . 0.0 110.489 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -108.72 120.18 41.73 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.058 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 74.2 t -92.04 107.09 18.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.035 0.445 . . . . 0.0 109.971 175.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -91.51 100.38 13.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.944 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -85.56 88.99 7.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.491 . . . . 0.0 110.471 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.569 ' HB3' HG22 ' A' ' 71' ' ' ILE . 87.7 m-85 -77.79 88.04 4.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.542 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.495 ' HA ' ' HA ' ' A' ' 42' ' ' CYS . 22.2 pttp -62.75 132.26 51.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.231 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.756 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 70.5 mt -98.8 125.9 52.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.499 -176.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -109.27 137.52 47.03 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.333 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 1.02 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 23.1 mtpp -84.71 145.21 28.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.502 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.99 -6.69 48.92 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 168.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.414 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 10.2 t70 73.93 -55.57 0.66 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.649 178.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.0 m -105.94 24.98 11.49 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.949 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.62 -107.82 0.46 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.291 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -129.42 -157.04 9.04 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.205 -174.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -119.38 141.75 48.79 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -146.07 136.05 23.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.507 0.67 . . . . 0.0 111.6 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.722 HG12 HG12 ' A' ' 61' ' ' ILE . 69.9 mt -82.77 -48.3 17.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.13 173.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -118.53 150.78 39.05 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.904 176.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -81.1 51.53 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -135.96 -77.53 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.326 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.0 m -94.47 104.47 16.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.209 0.528 . . . . 0.0 110.01 178.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -110.7 150.21 29.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 -173.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -129.51 141.55 50.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.977 0.417 . . . . 0.0 110.916 -178.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.497 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 15.8 m -83.1 20.46 1.23 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.686 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.9 t -167.57 161.45 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.537 ' O ' HG23 ' A' ' 84' ' ' VAL . 58.5 mt -83.48 -34.38 25.39 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -171.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -43.62 80.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -57.39 -36.33 71.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.414 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -61.81 -62.48 1.77 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.65 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -63.61 -43.21 98.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.157 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.04 -45.13 79.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.75 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -75.24 -42.61 54.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.776 0.322 . . . . 0.0 110.994 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.619 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-30 -70.16 -4.15 20.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.509 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -29.39 65.76 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.332 0.587 . . . . 0.0 109.725 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -107.11 -48.02 3.56 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.704 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.619 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.9 m-70 -107.24 102.41 11.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.276 -179.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -68.42 -37.08 79.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.814 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 t70 68.39 -71.63 0.11 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.69 175.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.44 -39.23 3.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.127 -0.558 . . . . 0.0 111.86 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.57 HD11 ' H ' ' A' ' 94' ' ' LEU . 4.9 mp -63.04 146.54 53.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.876 0.369 . . . . 0.0 110.68 176.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.1 -15.6 56.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.335 177.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -133.42 135.31 44.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.579 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -85.1 152.41 23.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.034 0.445 . . . . 0.0 110.63 -179.179 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 56.6 mt -67.56 101.83 1.06 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.959 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.2 m -91.58 -62.84 1.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.546 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.2 p-10 -133.67 147.92 51.45 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -177.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.528 HG21 ' CZ ' ' A' ' 29' ' ' PHE . 2.3 t -91.13 151.75 3.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.251 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 52.4 t -57.97 124.71 70.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.016 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 9.2 Cg_endo -89.76 178.14 2.44 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 123.39 2.726 . . . . 0.0 112.277 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.4 p -110.42 132.72 53.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.434 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 45.2 t 64.18 61.07 0.93 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.479 0.487 . . . . 0.0 110.853 -175.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.357 177.846 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 121.47 0.653 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.02 144.92 0.46 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.052 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.484 ' HB2' ' CB ' ' A' ' 6' ' ' TYR . 5.9 mm-40 -69.55 137.46 52.44 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.428 ' O ' HG12 ' A' ' 101' ' ' VAL . 28.5 mm-40 -55.0 -29.69 57.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.504 -172.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.407 ' HE3' HG11 ' A' ' 31' ' ' VAL . 9.0 p-90 -96.14 -33.94 11.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.484 ' CB ' ' HB2' ' A' ' 3' ' ' GLU . 9.8 t80 -79.54 93.64 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.796 -174.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.437 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.9 m-85 -80.74 -21.48 41.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.115 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.57 -158.05 27.11 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.596 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HG2' ' HB2' ' A' ' 33' ' ' GLU . 66.5 mttm -79.26 55.14 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.6 pt -78.18 153.69 5.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -83.96 154.14 23.5 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.785 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 13' ' ' ARG . 17.8 ptt85 -56.94 -40.07 75.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -170.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.423 ' N ' ' HG3' ' A' ' 12' ' ' ARG . 22.3 tpp180 -60.54 -35.01 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.63 0.253 . . . . 0.0 110.72 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 46.7 mt-10 -65.56 -40.25 92.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.229 177.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.6 m -66.58 -47.6 72.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.269 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.24 -40.17 96.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.639 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -57.64 -31.99 66.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.277 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 92.0 mt -84.86 -39.66 18.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.397 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.485 HD22 HD23 ' A' ' 30' ' ' LEU . 60.2 mt -80.77 -27.93 36.58 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.461 HD11 HD12 ' A' ' 54' ' ' LEU . 3.8 mm? -79.83 50.71 1.21 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.669 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -135.99 139.23 29.75 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.49 14.41 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.202 2.601 . . . . 0.0 112.843 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -97.32 -1.74 43.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.419 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 41.2 m-80 -110.34 112.76 56.84 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.358 -177.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 30.2 Cg_endo -65.36 157.0 60.27 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.53 2.153 . . . . 0.0 111.432 175.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -63.13 99.76 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.98 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 138.32 -0.66 2.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.072 -174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 59.7 m -72.38 124.68 25.64 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.585 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 31.7 p90 -132.15 166.07 22.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.14 0.495 . . . . 0.0 112.127 -173.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.485 HD23 HD22 ' A' ' 19' ' ' LEU . 1.8 pt? -160.3 143.51 13.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.713 170.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.469 ' HB ' HD23 ' A' ' 43' ' ' LEU . 3.1 p -107.12 115.44 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.636 0.731 . . . . 0.0 111.171 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.505 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 1.6 ptm180 -104.05 157.4 17.14 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.812 177.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.548 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 49.5 mt-10 -96.31 137.68 35.03 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 174.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -82.81 118.11 23.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.604 0.716 . . . . 0.0 109.398 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -40.18 96.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.996 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -84.98 -65.87 0.96 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.323 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.2 m -77.68 92.09 4.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.439 0.637 . . . . 0.0 110.567 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -82.32 151.98 26.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.756 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.442 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 82.67 14.43 75.78 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -172.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -149.49 113.83 5.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.968 0.413 . . . . 0.0 110.173 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.796 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 22.9 m-85 -92.62 175.41 6.83 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 43.8 t -135.31 102.93 5.32 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.206 -178.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.469 HD23 ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -85.62 91.34 8.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 m -86.65 121.23 28.88 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.08 -179.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.9 p -118.72 138.38 49.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.132 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -78.88 120.34 23.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.795 0.807 . . . . 0.0 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.598 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 9.5 t70 -107.26 76.06 1.06 Allowed 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.024 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 54' ' ' LEU . 74.3 t80 -77.54 95.15 4.45 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.54 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -95.92 154.95 16.96 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.211 -177.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -84.15 -16.29 44.08 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.355 -173.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.99 -43.74 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.75 0.31 . . . . 0.0 111.165 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -82.69 -37.26 25.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.051 0.453 . . . . 0.0 110.818 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 108.61 -162.85 12.82 Favored Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 -176.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.576 ' HA ' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -79.61 104.99 10.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.676 0.751 . . . . 0.0 111.759 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 10.1 m-80 -102.14 157.18 17.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.322 178.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.0 t -112.79 115.56 50.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.143 0.497 . . . . 0.0 110.259 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -93.52 109.15 20.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.601 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -89.31 98.7 11.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.855 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -92.58 103.45 15.85 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -69.69 125.71 27.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.327 0.584 . . . . 0.0 111.048 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.796 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -91.97 93.9 4.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.38 155.18 23.64 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.023 -173.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 59.8 mtpt -105.43 146.63 29.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.792 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.419 ' O ' ' HB3' ' A' ' 65' ' ' ASP . 98.4 mt -78.8 -74.22 0.29 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.206 173.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 6.2 p-10 173.2 -44.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.543 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.7 p -136.86 -29.89 0.9 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.899 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.48 -44.76 97.58 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.766 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.42 -147.36 18.57 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.889 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -109.86 152.16 26.12 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.05 0.54 . . . . 0.0 109.684 -177.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -150.52 135.75 17.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.192 0.52 . . . . 0.0 111.305 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.625 HG12 HG12 ' A' ' 61' ' ' ILE . 66.5 mt -92.0 -24.02 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 122.198 0.999 . . . . 0.0 108.469 171.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.4 t -148.71 145.66 27.77 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.348 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -64.97 -21.4 66.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -169.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -86.48 -0.87 56.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.9 m -147.04 108.81 4.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.33 133.47 55.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.197 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -123.02 132.9 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.774 0.321 . . . . 0.0 110.622 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 m -79.45 3.4 18.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.6 m -150.68 132.63 15.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.559 ' O ' HG21 ' A' ' 84' ' ' VAL . 30.7 mt -66.19 -25.32 66.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.682 -177.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -62.7 -46.8 86.45 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -66.67 -32.07 73.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.55 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.571 HD11 HD12 ' A' ' 71' ' ' ILE . 3.4 tm? -57.56 -65.95 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.302 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.559 HG21 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -62.54 -43.63 98.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.98 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.175 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -76.74 -43.56 36.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.729 0.3 . . . . 0.0 111.053 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.663 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 25.4 m-85 -70.73 -9.09 56.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.608 -177.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.641 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 70.6 m -67.45 -28.39 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.212 0.53 . . . . 0.0 110.013 173.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.49 -48.53 3.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.663 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 56.2 m170 -110.27 116.47 31.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.29 178.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.47 -38.01 65.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.814 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 61.02 -78.98 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.092 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.86 -40.59 5.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.739 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.579 HD11 ' H ' ' A' ' 94' ' ' LEU . 5.0 mp -67.17 149.36 50.59 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.956 0.408 . . . . 0.0 110.081 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 59.1 m -76.67 -17.93 58.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.537 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -133.04 134.02 43.83 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -68.95 151.27 46.75 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 74.2 mt -67.79 84.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.202 0.525 . . . . 0.0 109.848 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.8 m -73.82 -58.76 3.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.234 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.462 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -139.75 146.84 40.02 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.069 0.461 . . . . 0.0 110.095 -177.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.509 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.5 t -89.31 149.4 4.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.8 -179.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -65.68 119.13 57.9 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.155 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.5 135.69 26.95 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.588 2.192 . . . . 0.0 112.465 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.0 p -81.7 114.17 20.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.762 176.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.0 t -130.86 123.49 29.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.559 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.103 0 O-C-N 123.744 0.653 . . . . 0.0 110.261 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 . . . . . 0 CA--C 1.514 -0.406 0 CA-C-O 120.29 0.09 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 30.42 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.788 1.635 . . . . 0.0 113.333 -173.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 5.1 p-90 -81.38 -34.78 31.47 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.997 -173.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.56 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 1.0 OUTLIER -86.45 88.45 7.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.083 0.468 . . . . 0.0 110.462 -174.871 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -75.98 -30.37 58.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.759 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.3 -157.72 14.76 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.737 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -82.49 57.52 3.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.484 0.659 . . . . 0.0 111.466 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.02 134.49 26.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -73.83 165.06 25.79 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.854 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' HE ' ' CD ' ' A' ' 16' ' ' GLU . 19.4 ttt180 -54.94 -49.57 71.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.743 -0.208 . . . . 0.0 111.238 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -61.5 -41.32 97.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.609 -175.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -61.57 -42.4 98.8 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.355 0.598 . . . . 0.0 110.019 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.2 t -67.83 -41.21 83.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.085 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.406 ' CD ' ' HE ' ' A' ' 12' ' ' ARG . 49.6 mt-10 -61.53 -42.19 98.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.503 0.192 . . . . 0.0 110.972 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -57.98 -35.37 71.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.334 . . . . 0.0 110.908 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -78.13 -40.94 36.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.804 HD21 HD22 ' A' ' 30' ' ' LEU . 97.2 mt -76.95 -39.21 51.44 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -174.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.01 38.16 0.27 Allowed 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.469 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 23.7 m-80 -89.51 118.75 69.34 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.23 -18.07 17.18 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.359 2.706 . . . . 0.0 113.461 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -86.58 -2.26 58.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.533 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.469 ' ND2' ' HB2' ' A' ' 21' ' ' ASN . 95.9 m-20 -84.89 131.89 47.69 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.813 0.339 . . . . 0.0 110.421 177.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -82.64 156.42 16.09 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.705 2.27 . . . . 0.0 111.919 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 33.8 ttp180 -61.64 123.32 17.57 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.096 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.51 -5.0 10.91 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.436 -175.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 87.0 m -66.06 114.38 5.17 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.908 0.416 . . . . 0.0 110.123 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 43.2 p90 -128.55 166.7 18.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.755 0.312 . . . . 0.0 111.625 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.804 HD22 HD21 ' A' ' 19' ' ' LEU . 1.7 pt? -169.11 152.03 4.94 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.3 p -110.54 119.28 59.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.443 0.64 . . . . 0.0 111.006 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 10.5 ptp85 -102.04 151.32 22.29 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.495 178.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -93.85 117.22 29.81 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -76.71 121.4 23.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 0.0 110.946 -174.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -91.98 -16.12 26.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.059 174.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 t -88.73 -13.88 38.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.627 0.727 . . . . 0.0 109.582 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.6 m -139.35 93.17 2.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.658 171.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -69.96 141.87 52.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.651 -173.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.54 64.96 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.872 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.35 144.2 33.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.027 0.442 . . . . 0.0 110.341 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.604 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.0 m-85 -113.52 172.78 6.76 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.2 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 39.9 t -140.01 112.16 7.64 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.786 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.55 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.4 tm? -85.33 102.34 13.3 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 173.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 t -99.51 124.67 44.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.653 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -118.22 138.15 49.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.125 0.488 . . . . 0.0 110.58 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.9 m -91.05 105.84 18.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.437 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.478 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 3.7 m-20 -88.8 169.11 11.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.189 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -143.68 123.92 13.78 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.448 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -128.13 135.51 49.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -80.94 51.84 1.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.773 0.797 . . . . 0.0 109.772 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.51 -26.29 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.282 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -114.11 -20.34 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.342 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.13 -158.32 34.5 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.9 mp -74.32 114.01 12.19 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.84 127.52 49.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.346 0.593 . . . . 0.0 110.57 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 98.6 t -86.06 121.37 37.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.056 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.567 ' NZ ' ' HB2' ' A' ' 57' ' ' LYS . 3.4 ttmp? -102.05 110.41 22.37 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.726 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -89.08 99.76 12.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.702 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.411 ' CD2' ' HG ' ' A' ' 94' ' ' LEU . 12.9 m-85 -91.11 142.93 27.22 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 13.0 mmmm -99.42 131.58 45.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.925 -172.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.604 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -98.5 98.82 7.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.706 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.464 HH11 ' HD2' ' A' ' 62' ' ' ARG . 54.6 mtt180 -83.21 150.82 25.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.926 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -109.79 128.27 55.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.288 0.566 . . . . 0.0 111.646 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.494 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 79.3 mt -90.37 136.53 33.0 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.73 -12.25 59.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.201 0.524 . . . . 0.0 110.851 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -135.43 42.15 2.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.38 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -159.05 -70.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.804 -178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 156.87 -123.65 1.33 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.276 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -119.91 144.49 47.4 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -175.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.429 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 15.3 p90 -156.94 136.61 12.34 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.531 . . . . 0.0 110.849 175.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 60' ' ' LYS . 58.8 mt -87.11 -30.21 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.094 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -140.74 157.21 45.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.447 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.4 m -74.69 42.53 0.17 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.252 0.548 . . . . 0.0 111.575 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -125.95 -71.9 0.68 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.546 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.408 HG21 ' CE2' ' A' ' 86' ' ' TYR . 0.2 OUTLIER -96.11 125.6 40.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.959 179.085 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -130.93 131.14 44.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.913 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.594 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 92.9 m-85 -130.9 146.54 52.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.705 -175.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.428 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 19.9 m -83.42 3.12 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 41.2 m -152.06 156.74 40.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.549 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.6 mt -66.38 -43.49 85.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.835 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -58.76 -47.34 85.04 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.841 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.477 ' HB3' ' HB3' ' A' ' 77' ' ' PHE . 20.4 tt0 -56.32 -35.1 67.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.115 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.441 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 7.9 tt -69.56 -60.49 2.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.886 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -60.84 -41.54 89.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -53.84 -45.79 71.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.748 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 75' ' ' THR . 66.6 t80 -71.57 -46.08 60.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.858 0.361 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.594 ' HE1' ' HE2' ' A' ' 77' ' ' PHE . 2.5 m-85 -66.55 -11.93 55.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.22 -177.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.2 t -72.34 -27.42 62.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 110.344 176.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -104.53 -48.64 3.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.351 0.596 . . . . 0.0 110.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.7 t-160 -113.54 108.23 16.89 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.93 87.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.505 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.3 t70 67.75 -67.03 0.19 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.758 174.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -110.06 -32.26 2.88 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.212 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.2 mp -69.46 155.79 39.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.063 0.458 . . . . 0.0 111.07 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 m -78.55 -19.43 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.462 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -142.43 135.04 28.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.235 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -74.37 144.85 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.006 0.432 . . . . 0.0 111.174 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 69.6 mt -56.83 109.76 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.63 -176.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.1 m -98.71 -60.09 1.61 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 -173.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.577 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.7 p-10 -134.63 147.22 50.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.749 -176.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.423 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.1 t -88.37 146.58 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -55.39 122.07 41.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 O-C-N 123.718 0.636 . . . . 0.0 111.307 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -78.02 136.14 14.51 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.29 1.994 . . . . 0.0 112.086 177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 C--N 1.322 -0.623 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.041 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.454 -0.263 0 CA-C-O 121.088 0.47 . . . . 0.0 111.823 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -52.64 -39.45 61.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.506 -1.224 . . . . 0.0 113.423 -168.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -66.08 -33.35 75.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 79.2 t80 -83.47 99.93 10.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.776 0.322 . . . . 0.0 110.378 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.6 m-85 -83.68 -24.07 31.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.201 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.13 -166.14 13.35 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.86 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 44.6 pttt -86.69 78.81 9.05 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.632 0.73 . . . . 0.0 111.324 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 pt -97.79 149.81 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -76.53 171.01 15.33 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.83 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -58.18 -47.81 82.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.109 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.462 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 45.5 mtp180 -56.66 -41.6 77.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.166 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.88 -52.86 46.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.063 0.458 . . . . 0.0 110.531 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 6.9 m -62.14 -55.1 32.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.553 -174.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 56' ' ' VAL . 34.4 mt-10 -71.88 -22.51 61.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.094 -173.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 8.4 tpt180 -76.33 -23.23 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.059 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -88.85 -21.57 23.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.829 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.622 HD21 HD22 ' A' ' 30' ' ' LEU . 80.2 mt -93.88 -31.87 14.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.822 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.426 ' HA ' HD13 ' A' ' 20' ' ' LEU . 3.5 mm? -77.66 53.35 1.09 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.145 0.498 . . . . 0.0 111.298 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.523 ' HB2' ' OD1' ' A' ' 24' ' ' ASN . 87.3 m-20 -113.63 128.97 25.12 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 173.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.91 -12.2 21.3 Favored 'Trans proline' 0 N--CA 1.471 0.191 0 C-N-CA 122.843 2.362 . . . . 0.0 112.866 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -83.72 -33.63 25.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.796 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.523 ' OD1' ' HB2' ' A' ' 21' ' ' ASN . 4.3 m-20 -54.12 116.89 11.37 Favored Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.549 -178.075 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.96 151.44 24.1 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.487 2.124 . . . . 0.0 112.061 177.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -55.49 116.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.408 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.53 -2.89 9.49 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.804 -0.713 . . . . 0.0 111.958 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.503 ' HB ' ' HB2' ' A' ' 46' ' ' SER . 46.3 m -73.05 121.86 20.83 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 175.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -134.9 159.11 42.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.036 0.446 . . . . 0.0 111.873 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.622 HD22 HD21 ' A' ' 19' ' ' LEU . 2.3 pt? -155.59 137.35 14.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.97 170.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.4 p -99.8 114.48 38.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.717 0.77 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 ptt85 -115.11 160.17 19.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.575 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.663 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.9 tt0 -99.78 139.75 34.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.508 ' HB3' HG22 ' A' ' 36' ' ' THR . 45.6 m -100.11 115.77 30.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.292 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -64.32 -17.26 63.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.009 -174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.508 HG22 ' HB3' ' A' ' 34' ' ' SER . 10.6 t -61.47 -22.17 64.83 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.713 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.0 m -151.49 102.08 2.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.511 ' NZ ' ' HB2' ' A' ' 38' ' ' LYS . 4.4 ttmp? -55.61 113.36 1.42 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.095 -177.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.97 -2.2 48.01 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.612 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -100.01 112.96 25.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.793 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 75.5 m-85 -96.43 161.88 13.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.075 -177.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.53 117.7 19.12 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.83 176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -82.38 85.6 6.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.411 ' O ' HD23 ' A' ' 30' ' ' LEU . 19.2 m -74.46 111.9 10.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.907 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.8 p -107.86 136.86 41.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.006 0.431 . . . . 0.0 110.742 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.503 ' HB2' ' HB ' ' A' ' 28' ' ' THR . 15.4 m -81.04 107.55 13.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.875 176.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -102.86 147.87 26.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.849 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.559 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 88.1 t80 -133.46 113.7 12.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.404 0.621 . . . . 0.0 110.534 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -96.68 139.47 32.7 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.667 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -81.48 49.83 1.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.281 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -171.32 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.537 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -105.2 5.81 32.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.667 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.02 -146.62 38.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.138 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.559 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.1 mp -96.29 147.0 24.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 0.0 110.891 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -143.67 154.56 43.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.399 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.418 HG21 ' HG2' ' A' ' 16' ' ' GLU . 84.1 t -108.15 120.01 58.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 120.976 0.417 . . . . 0.0 111.078 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -102.14 114.42 28.54 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.688 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -89.71 86.04 6.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.052 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.408 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 49.9 m-85 -69.0 129.24 39.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.838 0.351 . . . . 0.0 110.805 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 38.9 mmtm -75.03 122.24 23.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.505 -172.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 59.2 mt -107.29 87.24 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -110.74 163.17 14.03 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.496 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 36.3 mtmm -99.29 150.17 22.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.34 0.59 . . . . 0.0 111.73 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.511 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 68.7 mt -95.56 177.11 5.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.79 -1.095 . . . . 0.0 109.993 172.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -51.23 -58.16 6.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.437 0.46 . . . . 0.0 110.897 175.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 p -142.21 14.43 2.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.045 0.45 . . . . 0.0 111.547 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -84.71 -32.96 20.33 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.348 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 110.19 -144.61 17.01 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.829 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -93.92 143.26 26.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.511 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 13.1 p90 -154.86 139.63 17.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.933 0.397 . . . . 0.0 110.74 177.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.65 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 62.1 mt -97.12 -26.27 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 122.071 0.939 . . . . 0.0 108.505 171.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.479 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.3 t -136.37 144.04 44.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.069 -1.423 . . . . 0.0 108.678 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.3 m -68.82 -15.74 63.59 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -170.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HD2' ' OD1' ' A' ' 92' ' ' ASP . 61.5 mtt85 -71.32 -58.74 3.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 0.0 110.874 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.42 HG21 ' CE1' ' A' ' 86' ' ' TYR . 25.1 m -102.54 124.08 47.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.28 -175.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -124.93 137.29 54.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.829 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -137.53 135.75 37.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.669 0.271 . . . . 0.0 110.784 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.0 m -88.38 14.18 10.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.152 0.501 . . . . 0.0 110.702 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 29.0 m -143.65 132.05 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.784 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.449 ' O ' HG22 ' A' ' 84' ' ' VAL . 88.6 mt -66.93 -25.29 66.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.06 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -48.11 79.09 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.95 -32.8 74.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.524 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -54.67 -64.8 0.72 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.534 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -66.64 -40.8 87.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.089 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.55 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.924 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.42 ' CE1' HG21 ' A' ' 75' ' ' THR . 60.9 t80 -93.04 -47.33 7.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.696 0.284 . . . . 0.0 111.04 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.65 ' HE2' ' HB ' ' A' ' 71' ' ' ILE . 2.8 m-85 -68.75 -9.0 48.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.035 -175.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.649 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 5.8 p -72.69 -33.37 66.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.374 0.607 . . . . 0.0 110.33 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -100.86 -39.83 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.678 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 34.3 m170 -115.47 111.99 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.93 -33.81 64.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.993 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.492 ' OD1' ' HD2' ' A' ' 74' ' ' ARG . 9.8 t70 62.9 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.566 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -101.23 -32.0 5.4 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 121.237 -0.506 . . . . 0.0 112.088 -178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.615 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -68.6 152.51 45.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 74.1 m -90.75 13.13 17.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 109.851 174.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -140.18 134.39 31.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.653 -175.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -97.78 120.22 37.78 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 63.9 mt -52.25 106.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 111.201 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.2 m -98.8 -58.47 1.94 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.269 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 p30 -135.45 151.95 50.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -90.23 146.41 6.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 120.773 0.32 . . . . 0.0 110.191 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 49.8 t -52.56 133.93 44.84 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.821 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.9 Cg_exo -65.9 135.73 42.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.796 2.331 . . . . 0.0 111.011 173.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -177.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.667 0.27 . . . . 0.0 111.327 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.444 ' O ' HG11 ' A' ' 101' ' ' VAL . 15.6 mm-40 -50.11 -51.91 39.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.604 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.535 ' CD1' HG21 ' A' ' 84' ' ' VAL . 1.2 p-90 -84.61 -23.71 29.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.163 -173.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.432 ' HA ' HG13 ' A' ' 31' ' ' VAL . 23.0 t80 -85.18 106.73 16.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.552 -173.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.6 -21.75 26.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.878 0.37 . . . . 0.0 111.098 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.08 -163.57 12.35 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.48 -0.867 . . . . 0.0 113.489 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -83.84 56.63 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.817 0.447 . . . . 0.0 111.219 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.538 ' O ' ' HD2' ' A' ' 32' ' ' ARG . 39.5 pt -90.41 139.21 17.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.084 0.468 . . . . 0.0 110.092 177.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -78.76 177.56 8.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.755 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -55.26 -46.82 76.09 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -177.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -56.12 -48.5 76.08 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.787 -177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -59.9 -36.12 76.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.241 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -64.38 -52.83 56.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.82 0.343 . . . . 0.0 110.449 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -70.11 -29.28 66.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.648 -179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -57.75 -40.01 78.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.019 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.2 mt -88.04 -31.15 19.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.873 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.55 HD21 HD22 ' A' ' 30' ' ' LEU . 59.9 mt -82.39 -30.65 30.08 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -172.136 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' HA ' HD13 ' A' ' 20' ' ' LEU . 1.9 mm? -77.52 26.65 0.17 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.241 0.473 . . . . 0.0 112.216 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -99.17 120.03 59.21 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.21 -3.63 4.25 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 C-N-CA 123.42 2.747 . . . . 0.0 114.034 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -77.57 -12.68 59.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.467 . . . . 0.0 110.463 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -83.83 124.65 74.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.998 -178.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.89 151.01 27.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.56 2.173 . . . . 0.0 112.232 175.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -56.28 113.46 1.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.687 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.55 10.04 8.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.192 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 88.2 m -83.35 114.89 21.73 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.301 0.24 . . . . 0.0 110.454 176.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -122.5 162.51 21.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 111.259 -175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.55 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -159.18 128.48 5.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.541 172.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.468 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 p -94.97 121.06 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.759 0.79 . . . . 0.0 110.659 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 38.3 ptt85 -108.69 160.1 16.22 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.794 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -92.71 135.96 33.65 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -97.38 101.06 12.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.35 -34.8 58.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.942 -171.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.8 p -86.49 19.3 2.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -173.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.505 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 26.5 m -152.2 124.29 8.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.963 0.411 . . . . 0.0 110.087 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -70.32 104.75 2.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.611 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.93 5.78 65.89 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.083 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.505 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -95.07 113.86 25.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.276 0.56 . . . . 0.0 110.312 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 71.9 m-85 -104.76 169.23 8.57 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.227 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.3 m -133.51 108.88 8.89 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.961 0.41 . . . . 0.0 110.542 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -83.07 84.77 7.34 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.5 t -81.27 127.82 33.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.383 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 13.9 p -125.61 138.61 53.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.0 t -78.25 119.45 21.64 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.725 0.774 . . . . 0.0 110.293 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -95.78 153.48 17.72 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.591 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -135.89 107.74 7.08 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.957 -175.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -90.77 139.81 30.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 173.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -84.13 -2.04 56.07 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -172.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -120.21 -51.22 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -84.62 -25.81 28.3 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.588 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.22 -166.69 12.17 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.081 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.623 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.5 pt? -79.3 146.25 33.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.104 0.478 . . . . 0.0 111.496 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -137.12 178.18 7.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.148 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 99.3 t -121.97 128.73 75.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.024 0.44 . . . . 0.0 110.306 177.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -111.26 95.53 5.58 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.547 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -76.94 91.58 3.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.458 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.489 ' HB3' HG23 ' A' ' 71' ' ' ILE . 70.4 m-85 -78.18 137.06 37.96 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -104.82 133.68 49.24 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.145 0.498 . . . . 0.0 110.982 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 71' ' ' ILE . 66.6 mt -104.23 96.38 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.103 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.7 ttp180 -88.22 134.69 33.72 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.969 0.414 . . . . 0.0 110.421 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -82.42 127.73 33.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.773 177.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.7 mt -99.64 115.33 29.18 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.237 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.01 -25.74 67.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.326 0.584 . . . . 0.0 110.089 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -99.29 11.43 39.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.239 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.51 -102.43 0.18 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.955 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -161.78 -136.38 1.99 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.25 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -114.39 138.61 50.33 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.413 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 13.7 p90 -147.91 143.33 27.29 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.102 0.477 . . . . 0.0 110.959 177.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 61' ' ' ILE . 57.9 mt -95.75 -36.76 6.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.159 174.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.01 148.18 52.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.365 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.454 ' O ' ' HD2' ' A' ' 74' ' ' ARG . 14.4 p -78.91 47.04 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -172.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 73' ' ' SER . 30.6 mmm180 -125.44 -62.72 1.19 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.4 m -108.93 133.4 53.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.63 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.413 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 72.6 mt-30 -129.17 135.22 48.56 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.538 0.209 . . . . 0.0 110.501 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -121.11 155.38 34.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.874 0.369 . . . . 0.0 110.867 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 p -93.41 -7.72 43.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 31.7 p -132.51 139.29 47.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.995 0.426 . . . . 0.0 110.146 177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.646 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.4 mt -68.47 -26.56 65.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.915 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -62.8 -47.3 84.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -71.23 -29.91 65.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.334 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.604 HD11 HD11 ' A' ' 71' ' ' ILE . 3.1 tm? -56.88 -62.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.045 176.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.8 m -64.35 -44.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.05 -46.28 71.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.74 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -73.78 -39.88 63.83 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.258 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 6.6 m-85 -74.0 -3.73 31.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.112 0.482 . . . . 0.0 111.536 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -82.26 -27.06 32.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 170.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.1 mttm -96.24 -49.91 5.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.807 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.618 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 35.1 m170 -125.53 119.29 27.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.2 174.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -70.45 -17.59 62.99 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.6 t70 66.55 -72.15 0.09 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.846 0.716 . . . . 0.0 111.193 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -116.31 -33.68 1.44 Allowed Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.623 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.4 mp -61.69 169.78 2.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.256 0.551 . . . . 0.0 111.057 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 41.8 t -116.35 -22.75 8.66 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.135 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 53.3 m80 -87.42 -32.02 19.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.202 -170.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 96' ' ' HIS . 49.5 mtp180 66.82 124.82 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.556 0.535 . . . . 0.0 110.018 -168.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 82.5 mt -61.03 104.45 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.607 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.6 m -96.02 -66.02 0.93 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.304 -173.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.9 p30 -133.02 150.13 52.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.51 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.7 t -89.91 145.72 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.1 t -46.33 130.38 7.77 Favored Pre-proline 0 C--O 1.234 0.256 0 O-C-N 123.99 0.807 . . . . 0.0 112.308 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.45 151.5 82.94 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.043 2.495 . . . . 0.0 111.916 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 C--N 1.318 -0.769 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.573 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 110.599 -0.148 . . . . 0.0 110.599 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -45.01 -48.44 11.57 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.49 ' HE3' HG11 ' A' ' 31' ' ' VAL . 7.7 p-90 -81.84 -43.03 18.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.651 0.262 . . . . 0.0 111.447 -178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 1.9 t80 -85.68 87.41 7.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.359 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.48 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 7.7 m-85 -67.04 -41.15 87.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.822 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.32 -165.61 18.41 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.752 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 pttm -84.29 73.65 10.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.506 0.669 . . . . 0.0 111.587 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.8 pt -94.61 144.99 8.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.986 175.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -84.23 177.53 8.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.244 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.468 ' HB3' ' OE2' ' A' ' 16' ' ' GLU . 25.1 mtp180 -56.08 -50.15 71.8 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 13' ' ' ARG . 52.9 mtp180 -52.86 -37.51 60.43 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.365 -178.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -79.45 -47.57 15.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.1 m -61.38 -49.24 77.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.984 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.468 ' OE2' ' HB3' ' A' ' 12' ' ' ARG . 42.1 mt-10 -68.27 -30.02 68.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.978 -177.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -59.89 -52.01 67.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.039 0.447 . . . . 0.0 110.858 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.522 HD22 ' OG1' ' A' ' 104' ' ' THR . 79.0 mt -70.12 -33.8 72.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.512 -174.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.771 HD21 HD22 ' A' ' 30' ' ' LEU . 55.1 mt -79.76 -32.9 41.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mp -81.27 8.78 8.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.79 0.328 . . . . 0.0 111.327 177.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.521 ' OD1' ' HG2' ' A' ' 23' ' ' GLU . 13.8 t-20 -67.52 126.68 92.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 175.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.54 23.66 0.17 Allowed 'Trans proline' 0 N--CA 1.478 0.597 0 C-N-CA 123.493 2.795 . . . . 0.0 115.514 -167.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.521 ' HG2' ' OD1' ' A' ' 21' ' ' ASN . 11.3 pt-20 -122.34 10.35 9.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.312 0.577 . . . . 0.0 110.063 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -96.83 122.12 57.62 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.274 -177.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -86.72 169.58 7.89 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.898 2.399 . . . . 0.0 111.758 173.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -61.89 112.2 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.591 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.69 2.8 6.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.399 -177.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 35.1 m -80.42 118.51 22.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CG ' HD22 ' A' ' 98' ' ' LEU . 28.7 p90 -129.78 165.83 21.14 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -173.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.771 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -164.64 145.84 8.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.3 171.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.49 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -108.15 124.45 64.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.328 0.585 . . . . 0.0 110.961 178.704 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.571 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 5.2 ptp180 -102.25 158.3 16.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.224 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -91.29 101.38 14.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 40' ' ' ALA . 34.5 t -73.93 111.78 9.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.111 0.481 . . . . 0.0 110.827 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.19 59.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 175.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 m -64.44 -36.33 83.83 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.813 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.9 m -147.6 109.46 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.325 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.59 132.84 53.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 92.01 1.74 69.76 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.827 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.543 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . -125.27 116.26 21.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.018 0.437 . . . . 0.0 109.864 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 90.4 m-85 -97.05 176.49 5.93 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.571 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 41.2 t -135.45 112.78 10.57 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.761 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.1 tm? -87.05 88.31 7.67 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 15.4 m -82.35 116.11 21.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.968 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 p -110.51 130.89 63.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.082 0.468 . . . . 0.0 110.038 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.497 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 41.4 t -78.24 122.58 25.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.341 177.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -116.87 123.68 47.63 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.943 -174.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.507 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 51.9 t80 -101.84 72.82 1.37 Allowed 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.54 ' HB2' ' HG2' ' A' ' 52' ' ' LYS . 15.5 m-20 -61.1 124.45 20.58 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.633 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -75.26 53.1 0.63 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.567 0.699 . . . . 0.0 110.834 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -162.22 -51.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.742 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.54 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 10.0 ptpp? -99.28 -23.58 15.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.173 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 97.89 -158.72 20.78 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.366 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 35.4 mt -64.55 120.67 12.78 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.403 0.621 . . . . 0.0 111.343 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.442 ' ND2' ' HD2' ' A' ' 52' ' ' LYS . 8.1 p30 -143.1 146.35 33.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.453 176.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.3 t -89.14 119.71 36.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HZ2' ' HB2' ' A' ' 57' ' ' LYS . 3.5 ttmp? -95.99 100.81 12.44 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -80.07 89.84 5.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.303 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -78.5 142.85 37.12 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -115.01 117.38 30.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.178 0.514 . . . . 0.0 110.76 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.683 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 63.5 mt -87.86 92.74 3.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.792 -178.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -100.2 144.01 29.73 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.911 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.67 157.77 19.0 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.791 -0.363 . . . . 0.0 110.056 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.415 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 7.7 mt -70.1 -91.69 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.956 176.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -134.16 -34.37 0.98 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.6 t -149.07 -31.13 0.24 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.068 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.48 68.57 0.36 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.51 -1.329 . . . . 0.0 113.519 -172.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -178.28 94.6 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.758 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -83.05 125.41 31.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.437 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 15.8 p90 -126.06 132.72 51.89 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.498 0.666 . . . . 0.0 111.768 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.63 HG21 HD11 ' A' ' 94' ' ' LEU . 65.4 mt -93.35 -39.69 11.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 168.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -121.16 179.79 4.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.891 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.0 t -73.18 -43.74 60.94 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -69.54 -56.71 6.58 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -170.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.451 ' HB ' ' CE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.68 120.59 32.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -169.917 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.437 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 2.2 mp0 -111.99 131.8 55.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.788 170.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.462 ' CE2' ' HE1' ' A' ' 87' ' ' TYR . 98.9 m-85 -123.28 131.34 53.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.636 0.255 . . . . 0.0 110.465 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.29 5.23 27.54 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.86 0.362 . . . . 0.0 111.783 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.1 m -147.7 137.54 22.74 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.961 0.41 . . . . 0.0 110.404 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.592 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.8 mt -72.75 -30.13 63.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.427 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -48.5 81.55 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -62.79 -35.72 80.79 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.565 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 HD11 ' A' ' 71' ' ' ILE . 2.8 tm? -58.34 -60.94 2.99 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.825 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -65.17 -44.13 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.48 -39.6 70.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.876 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -73.76 -48.52 31.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.592 0.235 . . . . 0.0 111.018 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 2.4 m-30 -69.99 -10.79 59.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.356 -177.025 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.513 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 10.7 t -70.28 -19.57 63.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.247 0.546 . . . . 0.0 110.132 176.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -116.15 -52.41 2.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.852 177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.517 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.1 t-160 -116.8 103.48 10.37 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.485 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -68.81 -27.34 65.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 -177.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.5 t70 70.11 -73.74 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.5 174.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.46 -49.57 2.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.794 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.74 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.3 mp -60.85 144.57 52.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.069 0.461 . . . . 0.0 110.643 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.9 t -74.6 -39.13 62.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -89.56 121.59 31.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.142 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.653 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -81.61 146.65 29.98 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.196 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.588 HD22 ' CG ' ' A' ' 29' ' ' PHE . 73.9 mt -69.04 85.68 0.35 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.218 0.532 . . . . 0.0 110.416 -177.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.7 m -78.17 -58.7 3.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.335 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.453 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.7 p-10 -132.94 143.74 49.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.949 -177.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.488 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -82.7 152.27 4.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.78 140.15 81.44 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.31 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.12 176.47 3.84 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.67 2.247 . . . . 0.0 111.167 172.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.522 ' OG1' HD22 ' A' ' 18' ' ' LEU . 24.0 p . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 123.463 0.705 . . . . 0.0 110.797 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 52.8 mm-40 . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -61.55 -52.46 64.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.002 0.429 . . . . 0.0 110.066 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 14.9 p-90 -79.79 -41.06 27.27 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.038 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.576 ' HE1' ' CE2' ' A' ' 41' ' ' TYR . 80.0 t80 -85.66 95.57 9.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.929 -177.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.583 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 30.6 m-85 -79.92 -20.96 44.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.209 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.76 -164.34 21.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.974 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 7.3 pttm -81.72 74.95 8.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.117 0.484 . . . . 0.0 111.846 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.678 HG13 ' HD2' ' A' ' 32' ' ' ARG . 39.4 pt -97.41 145.21 9.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -75.08 165.68 24.85 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.447 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 57.9 mtm180 -56.84 -51.0 70.72 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.104 0.252 . . . . 0.0 110.468 -176.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -49.48 -48.85 47.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.661 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.55 -47.58 84.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.299 0.571 . . . . 0.0 110.335 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 45.2 t -64.29 -47.3 80.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.326 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.496 ' HA ' HG21 ' A' ' 56' ' ' VAL . 48.3 mt-10 -68.96 -34.75 75.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.589 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.4 -25.05 68.11 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.489 . . . . 0.0 110.336 177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -88.07 -39.37 14.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.519 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.539 HD21 HD22 ' A' ' 30' ' ' LEU . 88.4 mt -77.02 -25.46 52.64 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.4 mm? -77.54 4.4 11.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.6 t30 -83.14 109.77 19.41 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.1 Cg_exo -65.67 14.39 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.883 3.055 . . . . 0.0 114.409 -170.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -83.54 -3.67 57.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.785 0.326 . . . . 0.0 110.51 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -110.96 143.22 27.84 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.541 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -82.0 164.41 17.7 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 123.09 2.527 . . . . 0.0 112.458 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.498 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 54.4 ttp180 -68.82 106.25 2.62 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.868 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.93 2.92 2.08 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 -174.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 68.8 m -76.64 132.46 39.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.198 -0.501 . . . . 0.0 109.757 175.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.564 ' CG ' HD22 ' A' ' 98' ' ' LEU . 31.0 p90 -137.04 166.33 23.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.158 0.504 . . . . 0.0 112.002 -175.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.583 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.3 pt? -162.51 141.9 9.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.391 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.75 118.16 55.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.502 0.668 . . . . 0.0 110.666 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.678 ' HD2' HG13 ' A' ' 10' ' ' ILE . 11.3 mtm180 -104.58 162.07 13.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.179 -177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.653 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.2 tt0 -97.63 129.91 44.69 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 174.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.2 m -67.85 140.98 56.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.519 0.676 . . . . 0.0 111.317 -176.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.74 -38.5 91.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.83 -177.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.6 p -103.21 -66.65 0.93 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.563 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.2 m -70.74 99.33 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.152 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.25 133.35 37.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.945 0.402 . . . . 0.0 109.923 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.69 -11.16 61.06 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -173.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.553 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -104.15 126.46 51.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.576 ' CE2' ' HE1' ' A' ' 6' ' ' TYR . 60.3 m-85 -117.34 143.33 46.07 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.175 0.512 . . . . 0.0 111.09 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.7 m -99.16 94.13 6.34 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 -176.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.723 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.2 tm? -81.24 98.38 8.07 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 172.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.7 m -97.86 132.83 43.11 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.729 -175.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.535 HG21 HD23 ' A' ' 94' ' ' LEU . 3.0 t -112.61 139.44 37.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.927 -177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.402 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 78.6 p -77.41 96.73 4.74 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.708 0.766 . . . . 0.0 109.388 174.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.81 138.81 31.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.596 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.498 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 79.7 t80 -122.59 122.45 38.88 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.302 0.572 . . . . 0.0 110.972 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -106.59 152.53 23.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.146 173.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -84.13 -1.92 55.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.746 0.307 . . . . 0.0 111.289 -173.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -123.2 -44.64 2.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.883 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -82.06 -25.52 34.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.164 -177.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.76 -141.58 17.25 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.815 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 78.5 mt -82.86 137.5 34.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.249 0.547 . . . . 0.0 111.322 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -146.4 154.83 42.08 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.496 HG21 ' HA ' ' A' ' 16' ' ' GLU . 58.3 t -97.83 115.56 38.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.966 -178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -89.98 105.72 18.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.679 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -86.7 107.26 18.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.885 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.619 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 4.0 m-85 -95.85 135.0 38.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.959 0.409 . . . . 0.0 110.713 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -95.34 102.7 14.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 71' ' ' ILE . 54.8 mt -82.24 87.01 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.1 mtm180 -86.01 156.07 20.6 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -107.94 155.49 20.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.297 0.57 . . . . 0.0 111.328 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 95.7 mt -108.18 141.21 40.27 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.912 -1.04 . . . . 0.0 108.868 172.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -64.3 -25.42 68.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.6 t -135.44 45.03 2.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.099 0.476 . . . . 0.0 110.13 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.09 -77.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.44 -157.03 28.62 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.005 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.459 ' HB3' ' CG2' ' A' ' 61' ' ' ILE . 73.5 m-85 -99.36 136.28 39.53 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -179.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.505 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 52.3 p90 -140.04 137.65 34.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.243 0.544 . . . . 0.0 111.078 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 61' ' ' ILE . 45.2 mt -82.63 -26.73 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.898 0.856 . . . . 0.0 109.385 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' HB2' ' A' ' 74' ' ' ARG . 8.8 t -155.59 167.87 28.98 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.269 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.9 t -80.71 54.39 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.686 0.755 . . . . 0.0 109.738 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.602 ' HB2' HG23 ' A' ' 72' ' ' THR . 13.7 mmm180 -126.34 -78.64 0.59 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.539 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.0 m -105.04 131.72 52.19 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.505 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 73.9 mt-30 -126.43 125.62 42.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.759 0.314 . . . . 0.0 110.8 -176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -121.54 141.11 51.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.312 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -78.49 -0.92 31.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -174.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.6 m -153.48 161.38 42.31 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.414 ' O ' HG22 ' A' ' 84' ' ' VAL . 96.0 mt -81.21 -19.8 42.46 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -168.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.6 tp60 -68.2 -45.19 74.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -59.48 -32.86 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.898 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.474 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -59.64 -63.92 1.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.413 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.428 HG22 ' H ' ' A' ' 84' ' ' VAL . 0.1 OUTLIER -64.16 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -176.338 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.72 -32.87 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -90.42 -44.58 9.55 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.223 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.584 ' HD2' HD13 ' A' ' 94' ' ' LEU . 16.1 m-85 -74.6 -7.16 52.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 23.0 p -79.26 -21.39 46.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.156 0.503 . . . . 0.0 109.707 172.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -100.96 -47.82 4.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.057 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 93.3 m-70 -127.14 117.79 23.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.446 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -67.55 -29.77 69.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.076 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.5 t70 64.75 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.561 0.538 . . . . 0.0 112.442 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -93.53 -34.84 6.44 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.646 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.0 mp -72.14 159.08 34.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.33 -0.435 . . . . 0.0 110.204 174.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 18.3 t -103.54 2.4 33.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.763 0.792 . . . . 0.0 108.877 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -123.91 112.05 16.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.311 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.9 ptt180 -68.49 136.48 53.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.4 mt -60.33 97.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.376 0.423 . . . . 0.0 109.977 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 11.2 m -89.68 -46.9 8.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.076 0.465 . . . . 0.0 111.291 -172.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.5 p-10 -146.92 154.17 40.98 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.703 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.9 t -91.62 155.37 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -177.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 43.2 t -54.3 120.22 24.61 Favored Pre-proline 0 C--O 1.236 0.347 0 O-C-N 123.535 0.522 . . . . 0.0 111.865 -177.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.9 Cg_exo -69.58 139.35 40.63 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 111.383 175.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -177.907 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 121.215 0.531 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -76.65 -42.94 40.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.525 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -75.26 -37.0 61.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.301 -172.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -86.35 105.23 16.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 0.0 110.68 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.493 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 22.7 m-85 -90.8 -11.41 39.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.32 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.74 -158.21 24.98 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.674 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 66.03 4.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.84 141.92 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.6 p -84.99 170.35 13.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.913 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -54.43 -51.06 66.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.702 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 35.7 ttp180 -53.37 -40.23 64.82 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.511 0.507 . . . . 0.0 110.793 -177.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -68.19 -53.61 23.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.498 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.2 m -61.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.235 -177.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.19 -24.04 63.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.208 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 38.6 ttp-105 -62.8 -37.97 88.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.789 176.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.31 -33.71 32.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.17 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.677 HD21 HD22 ' A' ' 30' ' ' LEU . 92.2 mt -78.87 -31.55 45.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -172.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.61 10.64 3.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 5.4 m-20 -86.55 125.36 67.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-O 120.716 0.294 . . . . 0.0 110.329 175.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 14.3 Cg_exo -69.88 8.48 0.79 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.3 2.667 . . . . 0.0 112.57 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -82.43 -15.6 52.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.779 177.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -92.34 133.5 29.82 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.945 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.61 144.28 35.44 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.858 2.372 . . . . 0.0 111.631 175.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.589 ' HD3' ' O ' ' A' ' 48' ' ' PHE . 43.6 ttp180 -52.68 114.35 1.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.486 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.58 7.07 6.39 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.432 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 51.7 m -72.19 116.43 12.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.0 110.872 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.539 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.8 p90 -126.61 165.99 18.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.926 0.393 . . . . 0.0 111.203 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.677 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -164.0 142.49 7.48 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 171.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.4 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -106.68 124.24 62.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.674 0.75 . . . . 0.0 110.775 -179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 15.8 ptt180 -115.14 147.69 39.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.249 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -78.7 121.58 24.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.131 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.8 m -96.62 119.72 35.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.271 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.55 -22.71 40.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.073 -174.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.0 m -69.37 -21.88 63.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.009 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 39' ' ' GLY . 97.4 m -149.92 120.3 7.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.451 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -81.16 15.22 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.206 0.527 . . . . 0.0 111.34 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.632 ' H ' HG22 ' A' ' 37' ' ' THR . . . -134.2 22.48 3.77 Favored Glycine 0 C--N 1.307 -1.048 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.065 -176.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.35 108.75 2.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.791 0.329 . . . . 0.0 111.339 -178.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.688 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 35.3 m-85 -85.93 152.77 22.69 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 170.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.463 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -109.79 105.81 15.17 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.674 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -90.33 91.82 8.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 173.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -87.48 107.83 18.75 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.973 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.1 p -108.15 130.69 60.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.993 0.425 . . . . 0.0 110.475 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 42.7 t -87.36 124.2 33.13 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.628 0.727 . . . . 0.0 109.918 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.424 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 12.3 t70 -120.42 135.41 55.05 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.093 -176.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.589 ' O ' ' HD3' ' A' ' 26' ' ' ARG . 75.0 t80 -116.74 149.07 40.48 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.801 -178.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.519 ' HB3' ' HB3' ' A' ' 52' ' ' LYS . 16.7 t70 -140.93 146.37 37.31 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -73.4 -13.87 61.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.3 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.52 -37.67 2.75 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 6.9 ttpm? -83.87 -25.23 30.42 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.862 0.363 . . . . 0.0 111.358 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.68 -164.98 34.75 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.929 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.9 mt -76.45 139.23 40.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.56 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -150.63 143.1 24.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.036 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.23 119.79 57.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.073 0.464 . . . . 0.0 110.4 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 44.0 mttm -94.19 99.46 11.71 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.67 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -80.99 86.81 6.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.319 -0.401 . . . . 0.0 109.93 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 45.5 m-85 -75.91 141.99 42.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.075 0.464 . . . . 0.0 110.885 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -98.69 109.36 22.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.778 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 71' ' ' ILE . 54.3 mt -84.02 92.09 2.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.498 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -76.57 146.68 38.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.73 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.845 ' HE2' ' HA ' ' A' ' 65' ' ' ASP . 21.2 ptmt -110.89 148.54 32.23 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.207 0.527 . . . . 0.0 110.602 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.1 mt -90.13 26.98 1.73 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.666 173.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.845 ' HA ' ' HE2' ' A' ' 63' ' ' LYS . 13.4 t70 63.91 -66.26 0.11 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.879 -174.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 54.9 m -125.04 -11.71 7.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -177.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -79.45 -18.13 74.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.834 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.5 -170.43 23.03 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.154 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -120.45 138.41 53.81 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.653 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 38.5 p90 -143.81 130.16 19.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.36 0.6 . . . . 0.0 111.569 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 61' ' ' ILE . 69.5 mt -77.97 -42.7 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.138 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.5 t -115.45 151.33 34.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.13 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.2 p -76.06 21.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.951 0.405 . . . . 0.0 112.045 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -104.69 -52.66 2.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.244 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.3 m -125.19 112.03 15.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.047 0.451 . . . . 0.0 111.714 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.653 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -109.85 150.87 27.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.354 176.275 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.469 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 88.0 m-85 -128.45 149.69 50.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.2 m -76.96 -12.05 59.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.212 0.529 . . . . 0.0 110.993 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 16.7 m -138.06 136.6 36.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.998 -177.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.558 ' O ' HG22 ' A' ' 84' ' ' VAL . 91.8 mt -69.83 -22.32 63.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.981 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -48.55 76.29 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.86 -34.76 78.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.413 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -55.2 -62.38 1.71 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.504 178.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -63.32 -41.63 93.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.856 -176.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.3 71.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.22 -43.04 65.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.207 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 5.8 m-85 -75.83 -2.11 28.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.138 0.494 . . . . 0.0 111.468 -176.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.0 t -78.96 -21.17 47.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.352 0.596 . . . . 0.0 109.392 172.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HE3' ' HB3' ' A' ' 89' ' ' LYS . 22.8 mtpp -109.13 -49.5 3.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.979 177.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.608 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 76.0 m-70 -111.65 101.11 9.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.5 177.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -69.97 -33.97 72.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 t70 62.94 -82.79 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.249 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.17 -42.38 8.75 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.707 -0.557 . . . . 0.0 111.707 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.611 ' HB2' ' HB1' ' A' ' 91' ' ' ALA . 5.3 mp -63.04 143.17 58.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.244 0.545 . . . . 0.0 110.939 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.0 -17.81 60.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -140.32 132.71 28.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.314 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.592 ' H ' ' HD2' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -69.19 142.54 54.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.929 -179.658 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -60.87 109.77 1.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.169 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -98.97 -51.49 3.84 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -171.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 28' ' ' THR . 2.6 p-10 -145.0 148.95 34.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.0 t -89.24 143.81 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 51.4 t -55.81 126.54 65.54 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.058 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 20.6 Cg_exo -65.95 129.69 22.61 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.713 2.275 . . . . 0.0 111.162 174.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 C--N 1.319 -0.717 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.978 -178.877 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.6 mm-40 . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 28.19 -78.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 125.461 1.726 . . . . 0.0 114.342 -170.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.453 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 10.7 p-90 -76.77 -35.56 57.63 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.546 -174.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.456 ' HA ' HG13 ' A' ' 31' ' ' VAL . 88.3 t80 -94.93 99.99 11.92 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.202 -176.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.636 ' HD2' ' HB2' ' A' ' 30' ' ' LEU . 42.2 m-85 -88.81 9.04 26.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.879 0.371 . . . . 0.0 111.923 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.01 -144.71 22.03 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.991 174.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -100.14 68.86 1.47 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.392 0.615 . . . . 0.0 111.636 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.0 pt -90.77 137.38 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.473 172.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -73.35 165.97 24.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.592 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -60.46 -37.8 82.15 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.581 -173.119 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 28.2 tpt180 -66.02 -40.32 90.98 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.528 -178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.57 -45.84 88.63 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.987 0.422 . . . . 0.0 110.598 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -61.94 -48.88 78.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.814 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -67.93 -33.52 74.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.891 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 tpt85 -58.13 -29.14 65.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.018 0.437 . . . . 0.0 110.505 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.95 -38.99 14.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.953 177.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.612 HD21 HD22 ' A' ' 30' ' ' LEU . 76.8 mt -74.88 -20.05 59.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -174.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.23 14.46 3.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.604 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 27.0 t30 -62.58 115.07 14.29 Favored Pre-proline 0 C--N 1.33 -0.253 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 170.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.504 ' HA ' HD11 ' A' ' 54' ' ' LEU . 29.0 Cg_exo -62.66 -0.42 1.95 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.402 2.734 . . . . 0.0 114.281 -171.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -112.26 1.63 16.22 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.318 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.604 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 92.2 m-20 -66.74 128.7 93.98 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 10.0 Cg_exo -70.61 142.44 44.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.845 2.363 . . . . 0.0 111.285 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.437 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 47.8 ttp180 -64.81 110.95 2.58 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.88 2.61 6.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.688 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 58.7 m -75.28 118.12 17.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.548 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.4 p90 -124.57 161.31 26.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.123 0.487 . . . . 0.0 112.117 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.636 ' HB2' ' HD2' ' A' ' 7' ' ' PHE . 1.8 pt? -161.44 138.88 8.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 0.0 108.979 170.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.495 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.6 p -106.51 125.64 62.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.679 0.752 . . . . 0.0 111.09 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 24.8 ptt85 -116.15 150.01 38.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.317 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -88.31 127.22 35.47 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.1 m -79.9 110.26 15.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.13 0.49 . . . . 0.0 110.985 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -25.06 61.32 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.6 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.86 -3.77 58.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.689 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.5 m -155.0 94.75 1.67 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.576 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -84.84 38.75 0.72 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.716 0.769 . . . . 0.0 110.993 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.01 12.91 4.73 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.186 -1.165 . . . . 0.0 110.186 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.567 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -163.0 142.13 8.66 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.936 -0.632 . . . . 0.0 110.382 -175.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 50.8 m-85 -109.15 179.3 4.2 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 173.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -134.42 109.08 8.52 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.228 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -90.25 87.51 6.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.4 m -80.69 119.96 23.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.625 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.67 139.79 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.035 0.445 . . . . 0.0 110.265 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.7 t -83.49 119.64 24.93 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 121.722 0.772 . . . . 0.0 110.384 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.437 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 12.7 t70 -106.47 145.64 31.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.282 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.539 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 77.9 t80 -123.32 124.75 43.67 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.644 -173.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -111.89 140.74 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.221 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -82.62 -11.08 58.65 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -172.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -113.51 -35.82 5.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.739 0.304 . . . . 0.0 111.136 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -87.5 -51.64 5.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.318 0.58 . . . . 0.0 110.32 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 131.83 -150.97 19.66 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -174.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.539 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.2 mp -90.54 139.31 30.81 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -125.73 130.37 51.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.2 t -93.25 112.68 26.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 121.23 0.538 . . . . 0.0 111.003 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -93.47 113.11 25.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.597 177.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.5 88.67 6.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.254 -176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 84.9 m-85 -75.79 112.79 12.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -81.93 122.9 28.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.401 -177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 71' ' ' ILE . 58.8 mt -92.07 92.09 3.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.138 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -75.01 146.01 41.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.262 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HB2' ' NZ ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -107.19 156.08 19.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.302 0.572 . . . . 0.0 111.631 -178.088 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.8 mt -95.08 149.87 20.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 165.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.68 -61.45 2.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.936 0.398 . . . . 0.0 111.28 -175.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.0 m -117.79 35.23 4.79 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.38 -107.25 2.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.02 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.86 -170.42 17.24 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.325 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.475 ' HB3' HG22 ' A' ' 61' ' ' ILE . 82.2 m-85 -101.82 138.43 38.81 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.65 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 52.4 p90 -143.93 135.31 25.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.214 0.53 . . . . 0.0 110.786 -178.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 61' ' ' ILE . 63.8 mt -82.9 -34.32 11.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.495 0.665 . . . . 0.0 109.373 174.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.5 t -126.95 154.77 44.11 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.647 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.1 m -77.88 56.01 1.49 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.164 0.507 . . . . 0.0 111.311 -175.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 74' ' ' ARG . 46.9 mtp180 -139.82 -71.6 0.38 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.656 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -105.28 104.81 14.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.207 -175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -111.7 154.58 24.76 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -136.89 137.6 39.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.912 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.8 p -69.62 -12.55 61.73 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.8 p -134.97 144.37 47.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.07 0.462 . . . . 0.0 110.061 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.0 mt -66.81 -21.74 66.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.578 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -59.52 -49.58 77.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.213 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -73.69 -26.54 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.628 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -57.29 -61.7 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.143 177.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.55 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -66.01 -44.33 92.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.599 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.79 -39.49 58.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.068 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -84.29 -40.85 17.48 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.062 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.642 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.3 m-30 -73.0 -7.87 53.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.894 0.378 . . . . 0.0 111.946 -176.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.524 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.3 m -86.1 2.33 47.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.346 0.593 . . . . 0.0 109.846 172.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -131.66 -38.32 1.16 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.48 -176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.642 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 74.8 m-70 -133.97 111.8 10.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.578 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -74.47 -35.15 63.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -173.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.7 t0 62.19 -82.41 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.891 0.744 . . . . 0.0 111.258 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -86.15 -37.5 9.07 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.837 -176.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.603 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -69.82 147.26 50.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.98 0.419 . . . . 0.0 110.913 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 70.2 m -73.22 -14.36 61.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.003 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -136.55 131.19 33.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.028 -177.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -64.68 133.97 53.27 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 172.731 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.548 HD22 ' CG ' ' A' ' 29' ' ' PHE . 81.1 mt -56.37 107.3 0.36 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.389 -176.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.6 m -96.64 -60.86 1.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.937 -172.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.432 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.6 p30 -131.89 149.47 52.43 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.19 143.53 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 54.0 t -50.71 120.45 13.14 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.63 -174.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.0 Cg_exo -71.33 130.77 17.92 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.969 2.446 . . . . 0.0 111.396 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.322 -0.627 0 CA-C-O 121.397 0.617 . . . . 0.0 110.892 179.747 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.55 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 67.1 mm-40 . . . . . 0 N--CA 1.456 -0.152 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' HG11 ' A' ' 101' ' ' VAL . 34.7 mt-10 -58.8 -27.53 65.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.1 -174.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.629 ' HA ' HG11 ' A' ' 101' ' ' VAL . 6.6 p-90 -104.91 -32.21 8.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.073 -175.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.558 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 58.8 t80 -90.29 111.02 22.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.796 -174.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -106.68 25.42 11.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.537 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 72.57 -150.37 44.85 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.529 -0.629 . . . . 0.0 111.529 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.8 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 15.9 pttm -107.87 71.04 0.79 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.469 0.652 . . . . 0.0 110.589 175.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 pt -73.65 149.27 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.168 172.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -77.86 167.1 22.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.231 -176.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -58.48 -44.1 89.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.82 -0.173 . . . . 0.0 110.81 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 15.9 mmm180 -53.46 -45.12 69.41 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 123.355 0.409 . . . . 0.0 110.753 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -66.17 -50.38 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.673 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.524 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 18.0 t -60.65 -51.5 69.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.356 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.599 ' HB3' HD23 ' A' ' 20' ' ' LEU . 68.9 mt-10 -77.21 -20.03 55.89 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.633 -174.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 46.4 ttp180 -61.71 -36.07 79.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.43 0.634 . . . . 0.0 109.329 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.5 mt -81.87 -44.14 17.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.034 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.582 HD21 HD22 ' A' ' 30' ' ' LEU . 78.4 mt -72.38 -28.77 63.22 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -173.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.3 mm? -82.88 19.67 1.32 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.958 0.408 . . . . 0.0 111.365 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.7 t-20 -99.59 119.69 59.42 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.2 Cg_exo -65.02 1.47 1.89 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.584 2.856 . . . . 0.0 114.521 -172.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -76.95 -16.88 59.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.409 . . . . 0.0 110.263 175.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -94.42 124.4 55.53 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.03 171.17 14.41 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.078 2.518 . . . . 0.0 112.765 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -58.88 109.66 0.87 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.62 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.43 -2.09 6.57 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.309 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 50.5 m -74.41 111.23 9.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.737 0.303 . . . . 0.0 110.327 176.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 34.5 p90 -127.26 166.39 17.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.99 0.424 . . . . 0.0 111.454 -175.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.582 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -162.32 145.27 11.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 170.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.486 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.8 p -107.87 123.78 63.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.793 0.806 . . . . 0.0 111.107 -176.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 30.4 ptt85 -126.92 138.14 53.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.348 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.8 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 7.7 tp10 -66.55 141.53 57.82 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.793 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 50.0 m -71.75 127.68 33.34 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.059 0.456 . . . . 0.0 110.023 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.625 ' HG2' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -58.43 -26.84 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.732 -175.346 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.625 HG23 ' HG2' ' A' ' 35' ' ' GLU . 17.2 p -118.66 24.21 11.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.818 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.793 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 7.3 m -141.03 137.19 32.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.869 0.366 . . . . 0.0 110.381 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -102.66 94.72 5.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.967 0.413 . . . . 0.0 110.705 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.76 50.83 2.06 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.352 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -159.19 99.3 1.48 Allowed 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 177.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.444 ' CE1' ' HE1' ' A' ' 6' ' ' TYR . 85.5 m-85 -89.92 139.41 30.62 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.705 -169.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 91.4 m -95.93 98.4 10.37 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.882 177.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.486 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.0 tm? -73.37 92.99 1.88 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 174.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 13.9 m -88.45 99.02 11.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.132 -174.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.9 p -101.97 125.38 56.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.257 0.551 . . . . 0.0 110.519 178.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.572 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 46.8 t -82.49 130.28 35.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.819 177.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.487 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 29.7 t70 -113.98 126.99 55.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.713 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -96.72 97.39 9.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.615 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -101.95 148.56 25.2 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.451 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -82.3 -20.79 36.73 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.246 -173.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -110.95 -46.33 3.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.959 0.409 . . . . 0.0 110.98 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -85.01 -15.34 44.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.201 -177.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.21 -156.61 35.91 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.825 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 22' ' ' PRO . 49.7 mt -76.95 106.29 8.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.546 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -119.56 125.38 48.67 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.711 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.14 120.02 37.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.441 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.487 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 55.3 mttm -93.59 103.03 15.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.068 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -83.37 90.05 7.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.189 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.484 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 71.7 m-85 -76.33 129.99 37.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.59 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -93.9 109.29 21.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.382 0.611 . . . . 0.0 110.844 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.484 HG12 HG12 ' A' ' 71' ' ' ILE . 68.1 mt -84.67 112.21 21.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.654 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -103.54 164.57 11.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.396 -177.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -118.08 133.7 55.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.082 0.467 . . . . 0.0 111.241 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.508 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 83.4 mt -88.06 136.76 32.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.951 175.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.67 -20.3 65.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.877 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.3 m -128.54 42.78 3.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.323 0.582 . . . . 0.0 110.627 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -168.39 -99.07 0.13 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.228 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -174.41 -147.99 6.37 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.621 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -88.14 142.5 27.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.713 0.292 . . . . 0.0 110.243 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.508 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 18.3 p90 -149.1 134.02 18.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.268 0.556 . . . . 0.0 111.049 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.578 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 70.3 mt -87.81 -26.71 5.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 169.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.3 t -146.5 152.86 39.67 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.925 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.8 m -82.19 56.24 3.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.915 0.388 . . . . 0.0 111.652 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -130.4 -54.75 1.1 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.999 0.428 . . . . 0.0 110.786 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -122.06 106.8 11.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' HD12 ' A' ' 64' ' ' LEU . 20.4 mp0 -99.58 146.37 26.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.656 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 82' ' ' GLN . 74.3 m-85 -136.98 135.98 38.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.991 0.424 . . . . 0.0 110.794 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.1 p -78.54 -27.12 45.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.089 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.458 ' HB2' ' HG3' ' A' ' 82' ' ' GLN . 4.3 m -110.47 135.79 50.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.478 . . . . 0.0 109.74 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.564 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.7 mt -65.74 -26.56 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.13 -178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -57.42 -40.83 79.17 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.23 0.538 . . . . 0.0 110.337 174.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.461 ' HB2' ' HB3' ' A' ' 77' ' ' PHE . 40.0 mt-30 -71.0 -36.56 72.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.034 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.426 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -58.06 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.711 -178.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -64.23 -42.52 95.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.076 -176.679 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.15 -50.3 71.53 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -72.89 -40.48 65.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 0.0 111.013 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.591 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.4 m-30 -75.7 -1.23 23.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.194 0.521 . . . . 0.0 111.331 -178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.8 t -75.55 -32.73 60.53 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.153 0.501 . . . . 0.0 109.768 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -105.46 -42.2 5.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.615 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.6 t-80 -101.3 100.75 11.3 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.73 74.32 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.362 0.414 . . . . 0.0 110.645 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.429 ' HB3' ' H ' ' A' ' 93' ' ' GLY . 1.6 t0 63.61 -86.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.568 172.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.429 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -103.47 -27.47 6.43 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.249 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.1 mp -70.64 145.52 50.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 110.521 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 40.8 t -68.76 -24.52 64.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.305 176.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -136.09 136.56 40.25 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.433 ' H ' ' CD ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -72.69 145.17 47.38 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.677 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.511 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -62.94 102.73 0.38 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.403 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.6 m -87.55 -67.08 0.85 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.851 -172.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.0 p-10 -135.94 144.32 45.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.132 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.629 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -90.0 145.06 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.8 t -73.47 132.9 80.88 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.243 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -88.12 173.06 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.027 2.484 . . . . 0.0 111.694 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 15.0 p . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 121.076 0.465 . . . . 0.0 111.038 179.916 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.8 -43.69 62.44 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.558 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 27.1 p-90 -66.25 -43.15 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -172.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG13 ' A' ' 31' ' ' VAL . 38.7 t80 -85.54 96.6 9.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.008 0.433 . . . . 0.0 110.502 -178.072 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -76.21 -62.68 1.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.342 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 138.36 -163.41 25.73 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -177.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.625 ' HB3' ' HB2' ' A' ' 33' ' ' GLU . 8.2 pttm -83.25 62.22 6.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 111.622 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 pt -78.03 132.33 32.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 169.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.3 p -74.68 177.56 6.04 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.815 -0.175 . . . . 0.0 111.399 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -58.79 -49.8 76.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -55.66 -36.01 66.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.361 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.645 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 35.9 mt-10 -78.4 -53.42 7.28 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.887 -177.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.1 p -62.21 -46.75 87.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.914 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.76 -48.52 76.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.085 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -59.11 -27.67 65.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.407 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 82.6 mt -71.88 -39.93 69.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 0.0 110.777 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.561 HD12 HG13 ' A' ' 56' ' ' VAL . 50.2 mt -87.55 -18.09 30.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.581 -175.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.2 mm? -77.73 8.01 5.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.124 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 23' ' ' GLU . 21.1 t-20 -91.19 113.0 56.84 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.529 ' HA ' HD11 ' A' ' 54' ' ' LEU . 60.5 Cg_endo -73.57 9.52 1.53 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.07 2.513 . . . . 0.0 113.501 -173.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.448 ' HB2' ' OD1' ' A' ' 21' ' ' ASN . 29.3 mt-10 -93.0 -10.28 36.82 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.498 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 91.3 m-20 -92.12 133.8 29.64 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.636 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 22.5 Cg_exo -65.39 160.89 40.4 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.183 2.589 . . . . 0.0 112.951 -177.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.694 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 57.3 ttp180 -72.15 120.19 17.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.754 175.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.64 6.21 25.24 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.837 -176.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 87.7 m -73.06 117.21 14.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CZ ' HG22 ' A' ' 101' ' ' VAL . 28.2 p90 -121.19 161.5 21.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.992 0.425 . . . . 0.0 111.923 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -166.16 135.02 3.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.127 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -99.49 125.3 53.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.602 0.715 . . . . 0.0 110.704 -178.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.592 ' CG ' ' HB2' ' A' ' 42' ' ' CYS . 5.4 ptm180 -112.3 148.19 34.72 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.939 -176.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.625 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 46.7 mt-10 -67.32 120.08 13.24 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 170.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.2 t -75.08 74.82 2.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 57.1 33.53 23.47 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.357 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.525 ' OG1' ' HD3' ' A' ' 9' ' ' LYS . 3.1 m 54.5 38.18 29.23 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.808 -176.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.1 m -79.16 103.85 9.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -61.51 124.06 19.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.919 0.39 . . . . 0.0 110.124 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.458 ' O ' ' HD2' ' A' ' 62' ' ' ARG . . . 106.89 -5.49 36.78 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.118 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -143.3 108.15 4.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.178 0.513 . . . . 0.0 111.254 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -118.5 139.66 51.09 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.592 ' HB2' ' CG ' ' A' ' 32' ' ' ARG . 35.7 m -97.63 104.56 16.59 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.052 -176.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.47 97.16 7.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 t -93.63 134.72 35.64 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.113 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 p -133.13 141.36 44.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.517 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 p -78.34 115.23 17.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.251 0.548 . . . . 0.0 111.074 -178.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.674 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 10.5 t70 -95.37 139.18 32.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.978 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.694 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 94.1 t80 -109.86 130.13 55.56 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.075 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -124.08 143.99 50.13 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -88.98 -8.37 54.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.148 0.499 . . . . 0.0 110.84 -172.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.15 -45.15 3.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.572 177.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -86.6 -37.09 18.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.434 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 114.93 -90.5 0.53 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.779 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.529 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.3 mt -130.19 147.62 51.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.021 0.438 . . . . 0.0 111.331 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -134.68 149.54 50.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.109 174.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.561 HG13 HD12 ' A' ' 19' ' ' LEU . 39.0 t -107.75 114.8 47.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.968 0.413 . . . . 0.0 110.471 178.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.674 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 67.0 mttm -95.42 108.18 20.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.356 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -88.7 88.86 7.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.92 0.391 . . . . 0.0 110.696 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -78.09 92.17 4.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.34 126.84 30.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.62 0.724 . . . . 0.0 110.932 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 71' ' ' ILE . 70.1 mt -96.12 127.61 48.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.909 -176.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 39' ' ' GLY . 24.2 tpt180 -99.31 140.86 32.87 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 28.1 ttpp -87.34 127.56 35.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' H ' ' A' ' 66' ' ' SER . 21.6 tp -75.53 125.93 30.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.556 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -60.8 -29.43 69.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.354 0.597 . . . . 0.0 109.891 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.507 ' H ' ' HG ' ' A' ' 64' ' ' LEU . 4.9 m -85.05 -45.42 12.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.998 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.425 ' H ' ' CG ' ' A' ' 64' ' ' LEU . . . -118.77 -109.1 2.37 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.118 -1.039 . . . . 0.0 113.154 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -130.46 -101.1 0.9 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.177 -173.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -133.07 150.4 52.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.645 0.259 . . . . 0.0 110.889 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -161.23 140.2 10.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.237 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 61' ' ' ILE . 55.9 mt -85.08 -27.99 6.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.36 0.6 . . . . 0.0 110.071 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 74' ' ' ARG . 4.4 t -151.06 150.86 31.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.86 -178.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.8 m -78.32 58.89 2.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.25 0.548 . . . . 0.0 111.504 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.669 ' HG2' HG23 ' A' ' 72' ' ' THR . 15.8 ptp180 -142.47 -28.71 0.59 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.936 175.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 36.9 m -139.2 124.49 19.12 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.549 177.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -126.23 144.53 50.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.741 -174.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.508 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 75.0 m-85 -130.96 179.53 5.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.744 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.41 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 14.3 m -95.13 -38.74 10.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.572 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 83.4 p -122.89 166.95 14.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.999 0.428 . . . . 0.0 110.666 -177.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.626 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.1 mt -77.62 -17.1 58.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.993 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -48.03 64.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.312 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -61.04 -37.75 83.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.788 176.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.651 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -54.13 -66.55 0.38 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.089 . . . . 0.0 110.709 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -61.34 -43.33 96.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -176.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.51 -42.17 77.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.988 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -82.32 -40.09 21.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.162 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.0 m-85 -74.63 -4.62 38.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.112 0.482 . . . . 0.0 111.194 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.3 t -76.91 -26.46 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.544 0.687 . . . . 0.0 109.427 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -101.88 -47.63 4.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.796 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 10.6 t-80 -113.14 109.63 19.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.795 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.62 88.85 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.339 0.399 . . . . 0.0 110.8 -177.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.422 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 37.6 t70 67.52 -78.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.089 0.868 . . . . 0.0 112.5 169.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -106.14 -37.18 2.55 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.933 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.62 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.14 145.81 54.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.3 0.571 . . . . 0.0 110.966 178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.23 -19.25 59.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.079 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -127.81 125.4 39.73 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 97' ' ' ARG . 7.2 ptp180 -69.75 153.12 43.81 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.477 HD22 ' CG ' ' A' ' 29' ' ' PHE . 63.4 mt -74.45 94.82 2.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.01 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.2 p -89.12 -78.2 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.725 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -111.07 145.25 38.85 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.544 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -88.37 138.06 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.4 t -55.73 124.4 56.87 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.397 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.52 133.35 23.99 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.068 1.846 . . . . 0.0 110.927 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.152 0.501 . . . . 0.0 109.796 177.608 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 110.486 -0.19 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -47.75 -53.17 16.03 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -170.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.5 p-90 -64.9 -40.9 95.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.489 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -85.48 85.51 7.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.102 0.477 . . . . 0.0 110.218 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 6.9 m-85 -67.75 -13.59 62.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.663 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 99.84 -148.03 18.4 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.983 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -95.79 50.52 1.21 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 0.0 110.801 -175.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.3 pt -75.02 147.31 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.7 p -73.85 157.32 36.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.074 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -56.9 -35.3 68.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.984 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 30.3 ttp180 -50.58 -57.18 8.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.874 174.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 27.4 mt-10 -68.61 -45.04 73.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.972 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.2 t -53.7 -58.58 6.68 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.708 -175.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.683 ' HB2' HG11 ' A' ' 56' ' ' VAL . 2.2 pt-20 -73.97 -36.02 64.54 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.456 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -56.73 -38.27 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.724 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 94.2 mt -63.65 -39.18 93.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.666 176.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.512 HD12 HG13 ' A' ' 56' ' ' VAL . 30.4 mt -77.25 -15.75 59.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.152 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.564 HD22 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -76.71 -4.42 43.19 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 122.231 -0.293 . . . . 0.0 111.6 175.691 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -73.87 110.66 9.68 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -57.21 -14.52 15.51 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.487 2.791 . . . . 0.0 113.998 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.49 -10.67 59.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 1.2 p30 -98.89 138.49 20.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 178.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 83.2 Cg_endo -88.09 173.15 5.0 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 123.198 2.599 . . . . 0.0 113.566 -176.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.432 ' HD3' ' ND1' ' A' ' 96' ' ' HIS . 26.1 ttm180 -68.5 128.35 36.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.747 176.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -5.0 22.36 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.562 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.63 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 33.0 m -73.34 130.36 40.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.076 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CG ' HD22 ' A' ' 98' ' ' LEU . 42.1 p90 -141.63 161.54 37.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.795 0.331 . . . . 0.0 111.501 -176.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.7 pt? -159.67 143.9 14.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.551 173.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -111.96 121.08 63.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.458 0.647 . . . . 0.0 110.801 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 32' ' ' ARG . 22.9 ptt85 -108.65 143.16 38.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.928 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -78.5 100.87 7.07 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.63 176.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -80.62 76.6 7.48 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -5.2 6.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.958 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -69.38 -26.57 64.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.283 0.563 . . . . 0.0 109.767 171.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.0 m -139.22 92.18 2.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.423 176.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -60.83 120.81 10.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.999 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 107.43 -6.27 36.07 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.196 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -114.49 95.61 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.323 0.582 . . . . 0.0 110.565 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.748 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.7 m-85 -87.07 148.97 25.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.904 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 59.3 m -109.39 106.12 15.78 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.665 -178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.709 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.4 tm? -86.82 90.48 8.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 174.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.3 t -81.89 129.73 34.85 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.463 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.25 143.18 41.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 120.932 0.396 . . . . 0.0 110.676 -176.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -83.44 113.82 21.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.114 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.592 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 8.2 t70 -93.92 142.58 27.22 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -126.51 118.1 24.22 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.958 0.409 . . . . 0.0 110.54 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -129.2 144.01 51.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.868 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -89.45 31.72 0.9 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.947 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -137.26 -49.57 0.61 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.304 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -99.16 -8.32 25.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.157 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.51 -134.92 12.87 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.232 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.1 mp -88.26 131.03 34.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.797 0.332 . . . . 0.0 110.59 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.592 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 30.8 m-80 -119.94 130.65 54.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.683 HG11 ' HB2' ' A' ' 16' ' ' GLU . 84.8 t -102.32 116.43 45.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.294 0.569 . . . . 0.0 111.022 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -109.62 116.99 32.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.331 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -89.07 99.79 12.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.878 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB3' HG23 ' A' ' 71' ' ' ILE . 31.3 m-85 -79.49 155.19 28.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.21 0.529 . . . . 0.0 111.424 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 1.9 mtmt -98.25 107.84 20.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.18 -169.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 71' ' ' ILE . 35.7 mt -99.01 75.71 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -98.28 133.64 42.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.462 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 27.8 ttmt -71.96 139.42 48.66 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.888 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.25 147.92 51.54 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 169.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -45.47 -47.3 14.0 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.639 0.587 . . . . 0.0 111.375 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.0 m -139.86 48.4 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.971 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -134.06 -107.34 0.97 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.354 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -151.24 -170.66 18.43 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.786 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 95.6 m-85 -91.01 141.23 29.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.695 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 53.5 p90 -145.11 143.57 30.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.648 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 61' ' ' ILE . 54.4 mt -90.95 -21.82 6.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 122.014 0.911 . . . . 0.0 108.934 172.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.659 HG21 ' HB3' ' A' ' 92' ' ' ASP . 4.2 t -149.29 153.49 37.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.541 -1.209 . . . . 0.0 109.13 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 m -78.37 46.79 0.65 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 111.828 -174.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -131.13 -67.03 0.72 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.275 0.56 . . . . 0.0 109.592 178.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.1 m -103.95 148.96 25.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.534 177.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.9 pt20 -159.48 148.69 18.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.599 0.237 . . . . 0.0 110.92 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -137.38 149.97 47.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 111.033 -176.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.8 t -82.69 -15.12 53.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.869 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.6 m -128.32 141.58 51.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.7 mt -67.6 -27.51 66.97 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.483 -173.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -66.82 -46.66 74.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.36 -30.68 71.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.654 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -54.03 -68.04 0.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.866 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -61.98 -42.64 95.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.889 -177.285 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.21 -47.2 72.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.082 -179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -81.0 -33.66 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.421 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 26.5 m-85 -70.85 -7.35 44.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.955 0.407 . . . . 0.0 111.465 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.1 m -79.86 -16.85 54.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.661 171.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -109.4 -27.36 9.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.33 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 0.1 OUTLIER -131.42 105.23 7.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.751 -176.591 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.4 ' HB2' ' HB3' ' A' ' 97' ' ' ARG . . . -72.48 -41.18 66.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.792 0.33 . . . . 0.0 110.864 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.659 ' HB3' HG21 ' A' ' 72' ' ' THR . 0.8 OUTLIER 59.89 -87.43 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.797 176.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -95.12 -30.57 8.19 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.112 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.625 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -68.96 141.49 54.94 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.148 177.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.1 -17.3 62.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.628 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.432 ' ND1' ' HD3' ' A' ' 26' ' ' ARG . 80.6 m-70 -137.26 130.28 30.65 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 91' ' ' ALA . 16.8 ptp180 -71.65 148.98 45.98 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.559 HD22 ' CG ' ' A' ' 29' ' ' PHE . 54.0 mt -62.39 120.09 10.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.546 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.5 m -111.43 -60.68 1.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.081 0.467 . . . . 0.0 110.933 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.63 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.9 p-10 -133.25 141.63 48.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.686 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.401 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -79.9 149.89 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -177.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.5 t -55.15 121.58 37.36 Favored Pre-proline 0 C--N 1.328 -0.349 0 O-C-N 123.645 0.591 . . . . 0.0 110.775 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -83.54 138.12 8.31 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.54 2.16 . . . . 0.0 111.515 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--N 1.323 -0.549 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.675 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -53.92 -34.61 60.07 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -166.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.6 p-90 -82.33 -35.86 27.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.491 ' CE2' ' HA2' ' A' ' 8' ' ' GLY . 64.9 t80 -87.22 109.29 19.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.967 0.413 . . . . 0.0 110.721 -177.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.613 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 40.0 m-85 -96.86 19.85 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.224 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.491 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 65.55 -141.53 42.57 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.357 177.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.616 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 58.8 mtmt -107.35 87.82 2.59 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.178 0.513 . . . . 0.0 110.848 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.8 pt -103.19 155.7 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.305 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 p -84.94 174.77 9.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 12' ' ' ARG . 18.6 mtm180 -59.67 -48.44 81.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.103 -177.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -54.96 -43.13 73.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.015 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.08 -52.25 66.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.003 0.43 . . . . 0.0 110.669 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -67.35 -47.98 68.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.143 -176.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.64 -42.08 87.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.57 -175.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -55.72 -41.47 73.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.075 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.85 -44.32 55.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.336 -177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD11 ' CD2' ' A' ' 30' ' ' LEU . 79.0 mt -78.4 -26.35 46.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -172.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' A' ' 20' ' ' LEU . 4.0 mm? -81.2 3.85 22.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 111.448 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.46 ' C ' ' H ' ' A' ' 23' ' ' GLU . 94.3 m-20 -73.99 138.02 76.1 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.85 30.37 0.29 Allowed 'Trans proline' 0 N--CA 1.472 0.222 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 21' ' ' ASN . 33.5 mt-10 -121.37 7.47 10.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.72 -178.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 48.7 m-80 -107.54 115.06 59.94 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.569 -178.217 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 52.1 Cg_endo -69.04 145.8 62.52 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.462 2.108 . . . . 0.0 110.444 170.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.692 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 55.2 ttp180 -60.71 114.67 3.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.25 6.15 7.64 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.35 -172.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.792 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 94.2 m -84.27 112.47 20.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.75 0.31 . . . . 0.0 110.316 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 33.5 p90 -117.09 158.28 24.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.055 0.455 . . . . 0.0 112.114 -171.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.613 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.8 pt? -154.02 138.05 16.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 170.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.61 118.26 55.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.446 0.641 . . . . 0.0 110.869 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -111.13 149.39 30.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.825 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 44.1 tt0 -92.43 130.5 38.09 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -107.51 98.54 8.14 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -72.21 -1.99 17.15 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.378 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.8 p -64.92 -19.48 65.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.601 0.715 . . . . 0.0 109.756 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.79 159.91 22.25 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.082 176.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -80.17 71.9 6.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.124 0.488 . . . . 0.0 110.811 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.37 32.23 12.32 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.843 176.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.67 141.17 30.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.92 0.391 . . . . 0.0 110.18 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.0 m-85 -117.3 165.4 13.51 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.54 -175.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.0 m -127.66 108.58 10.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.135 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.597 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.5 tm? -89.95 90.57 8.22 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.0 m -89.11 123.29 33.25 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.473 ' CG1' ' HB2' ' A' ' 57' ' ' LYS . 14.3 p -112.22 130.31 66.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.229 177.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 28' ' ' THR . 46.8 t -68.03 121.69 16.64 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.692 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 16.5 t70 -122.15 154.5 37.33 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.741 -170.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -135.87 95.8 3.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.502 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.51 118.18 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -75.1 60.53 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.66 0.743 . . . . 0.0 109.765 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.08 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.433 -1.258 . . . . 0.0 108.705 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -108.3 -63.7 1.3 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.81 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.74 -151.86 21.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.875 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.2 128.38 35.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.254 -178.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -151.59 177.53 10.25 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.21 119.95 59.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.664 0.269 . . . . 0.0 110.885 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 52.8 mttp -87.24 103.94 15.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -84.75 86.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.277 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.6 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 45.7 m-85 -72.41 127.77 33.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.178 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.406 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 23.7 pttm -83.39 124.84 31.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.042 0.449 . . . . 0.0 111.403 -176.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 71' ' ' ILE . 57.3 mt -102.25 106.33 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.676 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.439 ' HD2' HH11 ' A' ' 62' ' ' ARG . 11.4 mmt85 -108.81 172.18 6.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.224 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 51.9 mtmt -123.9 157.74 33.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.197 0.522 . . . . 0.0 111.659 -177.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.42 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 60.1 mt -123.51 151.09 43.17 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.724 178.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.33 -64.71 0.74 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 111.145 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 65.8 m -103.1 22.46 13.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.118 0.485 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 64' ' ' LEU . . . -112.97 -97.02 2.28 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.644 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 158.79 -149.69 19.92 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.61 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -80.75 126.6 31.51 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.5 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 30.3 p90 -140.48 141.15 35.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.249 0.547 . . . . 0.0 110.271 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 61' ' ' ILE . 23.9 mt -101.84 -6.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 122.31 1.053 . . . . 0.0 108.546 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.938 HG21 ' HA3' ' A' ' 93' ' ' GLY . 2.5 t -169.5 160.01 8.86 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.649 -173.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.2 p -74.12 0.38 14.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.757 0.313 . . . . 0.0 111.011 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -67.82 -54.73 16.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.443 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m -142.25 141.35 32.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.872 -174.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.5 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 24.7 mp0 -125.19 138.1 54.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.93 178.732 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -130.75 140.74 50.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 0.0 111.191 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.7 p -82.22 -8.63 59.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.332 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 24.7 m -131.23 132.73 44.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.032 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.561 ' O ' HG22 ' A' ' 84' ' ' VAL . 53.4 mt -64.65 -30.32 71.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.871 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.72 -46.15 84.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.329 175.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 7.9 mm-40 -77.0 -21.25 54.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -178.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.496 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -62.59 -59.69 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.509 174.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.93 -42.03 88.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.945 -178.215 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.0 -22.09 62.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -91.73 -48.88 6.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.739 0.304 . . . . 0.0 110.591 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.722 ' HD2' ' HG ' ' A' ' 94' ' ' LEU . 7.0 m-85 -73.13 -5.47 39.32 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.789 -176.127 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.9 p -78.67 -33.0 47.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.261 0.553 . . . . 0.0 110.244 173.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -95.8 -51.65 4.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.141 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.408 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 4.7 t-80 -120.89 107.27 12.49 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.323 177.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -62.58 -37.5 86.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.479 -176.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.41 -72.27 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.193 172.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.938 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -104.01 -22.68 8.63 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.722 ' HG ' ' HD2' ' A' ' 87' ' ' TYR . 15.4 mt -79.42 155.5 28.32 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 35.4 t -82.39 -29.18 30.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.34 0.59 . . . . 0.0 109.937 177.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -127.34 125.62 41.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.36 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -72.41 137.72 46.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.016 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.592 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 59.6 mt -61.42 100.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.791 -174.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -97.73 -53.38 3.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.697 -173.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.792 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 t30 -127.08 136.07 51.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.965 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -87.01 148.31 4.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.862 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.2 t -50.73 125.21 21.25 Favored Pre-proline 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 111.659 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -69.73 144.87 55.61 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.021 2.481 . . . . 0.0 111.749 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--N 1.318 -0.768 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.107 178.756 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 N--CA 1.452 -0.363 0 CA-C-O 120.437 0.161 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.453 ' O ' HG11 ' A' ' 101' ' ' VAL . 50.1 mt-10 -57.11 -40.77 77.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.045 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.624 ' HA ' HG11 ' A' ' 101' ' ' VAL . 4.6 p-90 -84.19 -41.62 16.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.508 ' HE1' ' HA2' ' A' ' 8' ' ' GLY . 2.6 t80 -85.41 104.36 15.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.665 -174.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -94.68 -2.66 50.82 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.508 ' HA2' ' HE1' ' A' ' 6' ' ' TYR . . . 79.14 -169.31 53.9 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.795 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 51.9 pttt -67.1 98.75 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 110.982 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.1 pt -125.66 141.58 45.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.486 172.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.2 p -73.73 152.37 40.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.258 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -60.01 -34.94 74.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.016 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.631 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 11.5 ptm180 -55.03 -41.88 71.91 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.334 0.396 . . . . 0.0 111.007 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HG2' ' HG3' ' A' ' 13' ' ' ARG . 4.9 mm-40 -82.17 -47.61 12.3 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 33.3 t -59.17 -49.3 78.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.674 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB2' HG11 ' A' ' 56' ' ' VAL . 3.9 pt-20 -79.9 -31.49 40.21 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.23 -174.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.631 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 24.0 ttm180 -58.13 -36.53 73.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 174.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 71.0 mt -60.48 -44.77 95.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.976 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.521 HD12 HG13 ' A' ' 56' ' ' VAL . 44.7 mt -74.79 -22.92 58.48 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.779 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.458 HD22 HG23 ' A' ' 56' ' ' VAL . 2.1 mm? -74.03 -7.95 54.33 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.419 175.103 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.425 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 94.0 m-20 -80.42 119.95 77.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HA ' HD11 ' A' ' 54' ' ' LEU . 13.1 Cg_exo -70.35 44.61 0.47 Allowed 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.484 2.789 . . . . 0.0 113.156 -177.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -115.39 -0.46 13.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.948 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -123.09 145.42 45.98 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.152 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -87.62 172.06 5.87 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.954 2.436 . . . . 0.0 112.439 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -64.15 125.73 25.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.927 177.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.54 12.14 21.84 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.327 -0.94 . . . . 0.0 112.126 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.54 ' HB ' ' OG ' ' A' ' 46' ' ' SER . 32.6 m -81.75 116.31 21.39 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 173.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.469 ' CG ' HD22 ' A' ' 98' ' ' LEU . 38.2 p90 -121.9 168.61 11.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.769 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.71 127.96 3.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 171.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.499 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -91.34 109.61 21.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.023 0.916 . . . . 0.0 110.088 177.618 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.482 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 18.7 ptt180 -109.49 153.98 23.3 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.587 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.61 152.48 24.8 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.748 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 3.0 p -59.8 125.66 24.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.89 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.07 -53.27 7.59 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.738 -175.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.9 p -108.88 -11.42 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.219 0.533 . . . . 0.0 110.474 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.748 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 6.0 m -91.61 158.93 16.14 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.514 -0.767 . . . . 0.0 108.958 175.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -118.41 80.28 1.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.143 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.11 54.51 0.52 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.389 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.84 88.84 1.13 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.158 0.504 . . . . 0.0 109.868 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.615 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 64.6 m-85 -64.0 141.22 58.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.077 -175.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.482 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 48.5 t -109.22 107.08 17.21 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.142 0.496 . . . . 0.0 110.576 -177.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -86.93 87.58 7.49 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t -87.06 132.2 33.88 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.6 p -126.46 140.15 49.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.874 0.368 . . . . 0.0 110.23 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.54 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 97.8 p -88.28 139.54 30.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.144 -178.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -123.87 126.87 47.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.325 0.583 . . . . 0.0 110.28 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -106.91 89.19 2.93 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.686 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.84 152.14 20.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.287 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -100.16 10.42 41.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.043 -174.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.01 -42.28 2.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.023 0.439 . . . . 0.0 110.425 176.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.54 -36.01 10.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.592 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 106.59 -156.77 16.05 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.967 -0.635 . . . . 0.0 111.57 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.438 HD11 ' HA ' ' A' ' 22' ' ' PRO . 20.7 mt -69.9 124.46 24.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.882 0.372 . . . . 0.0 110.965 177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -136.56 146.41 46.12 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.521 HG13 HD12 ' A' ' 19' ' ' LEU . 86.4 t -109.51 127.83 66.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.29 0.567 . . . . 0.0 111.217 -175.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -107.65 98.9 8.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.085 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -79.15 95.99 5.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.228 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.533 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 69.5 m-85 -84.8 148.29 26.4 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -114.31 122.05 45.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.092 0.473 . . . . 0.0 111.562 -173.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.615 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 83.5 mt -89.47 93.89 4.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.309 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 ttp85 -96.21 156.29 16.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -74.6 146.13 42.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.419 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.715 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 1.4 tt -53.79 -60.5 3.23 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.689 0.757 . . . . 0.0 109.884 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.5 t70 174.12 -30.29 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 113.477 -1.692 . . . . 0.0 107.582 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -125.39 -62.33 1.21 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.67 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.39 67.5 0.25 Allowed Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.951 -1.119 . . . . 0.0 113.265 -176.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -150.59 140.85 8.22 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -109.24 133.1 53.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.216 0.508 . . . . 0.0 110.098 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.715 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 53.6 p90 -148.03 149.07 31.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.523 HG12 HG12 ' A' ' 61' ' ' ILE . 58.3 mt -95.98 -20.89 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.978 0.894 . . . . 0.0 109.156 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -148.61 147.75 29.33 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.911 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m -76.12 55.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -138.49 -35.54 0.6 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -126.01 120.41 30.22 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.16 -0.216 . . . . 0.0 110.522 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -114.78 136.74 52.75 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -124.06 153.78 40.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.409 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.6 m -92.46 -19.4 22.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.091 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.2 p -131.16 145.7 52.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.951 0.405 . . . . 0.0 110.503 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.516 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.9 mt -75.89 -21.75 56.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -63.25 -43.11 98.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.168 175.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -73.24 -27.1 61.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.603 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.432 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -57.98 -62.81 1.55 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.064 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -63.63 -42.62 96.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -176.643 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.43 92.8 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.697 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -75.88 -42.19 49.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.876 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.576 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.1 m-85 -76.25 0.64 18.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.23 0.538 . . . . 0.0 111.79 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 t -80.97 -30.28 35.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 170.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -96.06 -40.08 9.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.853 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.576 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 3.5 m-70 -110.18 113.08 25.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.291 177.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.28 82.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.764 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.9 t70 68.23 -70.74 0.12 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.532 -1.213 . . . . 0.0 112.116 168.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -131.02 -29.71 0.6 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.331 -0.462 . . . . 0.0 111.981 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.574 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -60.93 -39.84 90.95 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.84 0.829 . . . . 0.0 112.275 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.4 t 83.17 -29.65 0.09 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 112.429 -2.169 . . . . 0.0 110.162 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -97.01 124.68 41.05 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 172.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.78 141.67 44.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.289 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CG ' ' A' ' 29' ' ' PHE . 66.8 mt -66.09 94.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.002 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.1 m -91.8 -63.81 1.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -172.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.4 p30 -133.24 163.35 29.49 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.624 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.4 t -102.26 145.64 11.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.026 0.441 . . . . 0.0 110.892 -174.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.9 t -57.74 137.29 82.87 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.43 -176.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 4.8 Cg_exo -76.33 176.54 9.93 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.527 2.818 . . . . 0.0 112.004 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.534 0.354 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.216 -178.406 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -56.27 -48.46 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.38 0.61 . . . . 0.0 110.216 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.676 ' HA ' HG11 ' A' ' 101' ' ' VAL . 8.4 p-90 -89.55 -44.3 10.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.3 -177.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.463 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 3.2 t80 -82.32 86.36 6.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.404 -175.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.556 ' CE2' ' HB ' ' A' ' 104' ' ' THR . 11.2 m-85 -69.86 -31.5 69.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.26 0.552 . . . . 0.0 110.847 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.8 -148.35 18.9 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.355 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -83.76 68.8 10.04 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.73 0.3 . . . . 0.0 111.343 -174.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.7 pt -95.47 150.01 4.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 p -82.3 166.38 19.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -71.06 -20.71 62.33 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -65.18 -44.79 87.34 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.57 -51.97 24.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.708 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 t -51.89 -68.42 0.17 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.624 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -29.29 66.61 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -61.25 -58.05 9.88 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.195 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 mp -63.96 -36.51 84.2 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.699 HD21 HD22 ' A' ' 30' ' ' LEU . 89.3 mt -70.54 -40.93 73.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.648 -177.18 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.33 57.96 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.324 0.583 . . . . 0.0 111.023 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 4.7 m-20 -121.08 119.25 29.83 Favored Pre-proline 0 C--N 1.321 -0.664 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 172.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 31.8 Cg_exo -60.28 -11.67 17.13 Favored 'Trans proline' 0 N--CA 1.473 0.321 0 C-N-CA 123.283 2.655 . . . . 0.0 113.187 -176.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -79.61 -19.15 49.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.95 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -87.92 130.31 47.06 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.046 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -84.85 166.99 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.683 2.255 . . . . 0.0 112.58 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.48 ' HD2' ' CE1' ' A' ' 96' ' ' HIS . 53.1 ttp180 -57.1 128.74 38.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.447 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.66 1.3 30.71 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.902 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 70.9 m -77.66 119.88 21.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 175.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.4 p90 -134.45 174.08 10.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.909 0.385 . . . . 0.0 111.74 -173.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.699 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -171.13 147.59 2.58 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.036 171.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -101.26 118.08 47.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.443 0.64 . . . . 0.0 110.771 179.261 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.429 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 18.1 ptt180 -117.31 155.71 29.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.121 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -99.63 135.83 40.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.002 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.451 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 43.1 t -84.71 121.6 27.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.009 0.433 . . . . 0.0 111.097 -178.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -81.0 -18.18 47.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.48 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.59 -28.19 26.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.747 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 61.7 m -135.06 93.24 2.97 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.194 0.521 . . . . 0.0 110.627 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 34' ' ' SER . 14.3 mmmm -71.72 113.23 8.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.851 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 122.62 3.13 9.43 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.49 -175.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.97 116.67 10.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.013 0.435 . . . . 0.0 109.908 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.794 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 17.4 m-85 -92.66 161.64 14.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.655 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.429 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 60.8 m -118.67 101.32 8.02 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.969 0.414 . . . . 0.0 110.71 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.3 tm? -77.56 97.95 5.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 5.0 m -92.34 105.63 17.79 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.122 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -113.56 136.67 49.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.043 0.449 . . . . 0.0 110.892 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.6 t -86.96 127.15 35.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.481 0.658 . . . . 0.0 110.632 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.454 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 7.4 t70 -112.34 140.08 47.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.791 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.434 ' CB ' ' HB2' ' A' ' 26' ' ' ARG . 78.9 t80 -111.11 114.88 28.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.091 0.472 . . . . 0.0 110.457 -176.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -112.35 153.75 26.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.072 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -75.51 -20.23 58.86 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.997 -172.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -112.25 -49.41 2.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -80.35 -17.48 51.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -176.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.71 -146.05 28.11 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.869 -0.682 . . . . 0.0 111.891 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.33 125.12 28.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.89 0.376 . . . . 0.0 110.373 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -131.37 138.11 49.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 77.9 t -98.64 124.23 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.165 0.507 . . . . 0.0 110.91 -176.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 57.0 mttm -102.88 116.68 33.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.974 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -91.69 94.94 9.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.583 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.493 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 62.3 m-85 -77.14 128.95 35.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.347 178.027 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -81.84 116.65 21.61 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 -176.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.794 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.5 mt -96.44 84.09 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 70' ' ' TYR . 43.9 ttm180 -90.12 139.04 31.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.474 . . . . 0.0 111.328 -172.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . 51.4 tttp -90.13 133.3 34.96 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.352 177.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.2 -81.36 0.13 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 177.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -170.13 -64.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.419 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 34.0 p -120.25 -23.28 6.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.714 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -64.7 -52.47 42.37 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.216 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.16 -147.64 19.32 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.344 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.612 ' CE2' ' HB2' ' A' ' 63' ' ' LYS . 84.2 m-85 -108.87 141.27 41.17 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.614 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 48.9 p90 -135.53 143.66 45.86 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.289 0.566 . . . . 0.0 111.398 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.528 HG12 HG12 ' A' ' 61' ' ' ILE . 61.3 mt -95.08 -24.78 4.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.914 171.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.3 t -133.6 149.64 51.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.2 m -78.39 59.73 2.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.932 -174.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 74' ' ' ARG . 13.8 ptt180 -169.28 -47.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.817 173.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.3 m -99.93 130.06 46.07 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.8 pt20 -149.66 153.9 37.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.749 0.309 . . . . 0.0 111.281 -174.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.47 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 93.2 m-85 -139.0 141.57 38.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.618 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.0 p -80.97 -10.8 59.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.617 0.246 . . . . 0.0 111.658 -174.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.5 m -132.29 138.48 47.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.643 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.11 -31.65 72.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.91 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -59.1 -48.64 80.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.611 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.415 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 14.4 mm-40 -65.56 -40.72 93.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.647 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.496 HD13 ' N ' ' A' ' 84' ' ' VAL . 1.3 tm? -51.04 -57.98 7.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.615 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.496 ' N ' HD13 ' A' ' 83' ' ' LEU . 9.2 p -75.64 -42.44 41.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.515 -170.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.84 83.96 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.335 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -76.66 -42.99 39.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.854 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.554 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -74.86 -16.66 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -175.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.743 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 79.8 p -69.41 -14.57 62.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.795 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -113.2 -59.23 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.354 0.597 . . . . 0.0 109.543 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 92' ' ' ASP . 6.5 t60 -98.84 95.33 7.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.796 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.85 -31.12 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 0.0 111.564 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.696 ' HB2' ' HD2' ' A' ' 90' ' ' HIS . 5.5 t70 53.3 -88.08 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.827 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.51 -43.62 12.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.408 -177.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.657 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -67.99 137.17 54.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.888 0.375 . . . . 0.0 110.81 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.72 -19.92 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.522 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.48 ' CE1' ' HD2' ' A' ' 26' ' ' ARG . 94.0 m-70 -120.03 139.51 52.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.455 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -74.76 134.21 41.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.669 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.743 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 84.9 mt -62.18 99.67 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.147 0.499 . . . . 0.0 109.783 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.7 m -84.73 -63.97 1.24 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.827 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.3 p30 -137.71 143.42 41.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.809 0.337 . . . . 0.0 110.22 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.676 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.9 t -88.3 132.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.4 t -65.4 128.35 93.72 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.58 147.09 35.39 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.491 2.127 . . . . 0.0 112.043 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.556 ' HB ' ' CE2' ' A' ' 7' ' ' PHE . 5.5 t . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 0.0 110.817 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 6' ' ' TYR . 20.9 mt-10 . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 119.96 -0.067 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 30.2 mt-10 74.14 -47.94 0.65 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.829 0.852 . . . . 0.0 110.313 -171.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.419 ' HE3' HG11 ' A' ' 31' ' ' VAL . 1.4 p-90 -89.76 -32.99 16.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.739 ' HB3' ' HA ' ' A' ' 3' ' ' GLU . 3.1 t80 -80.09 94.31 5.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.826 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.539 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 35.4 m-85 -85.75 -13.08 49.4 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.922 0.392 . . . . 0.0 111.133 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.29 -153.51 29.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.645 176.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.509 ' CG ' ' HB2' ' A' ' 33' ' ' GLU . 30.4 mtmm -82.04 53.88 2.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.856 0.36 . . . . 0.0 111.819 -175.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.463 HD13 ' HB3' ' A' ' 7' ' ' PHE . 34.2 pt -77.5 140.89 16.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 173.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -70.14 163.67 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' ' NH1' ' A' ' 32' ' ' ARG . 13.4 ptp180 -57.29 -32.78 66.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.212 0.529 . . . . 0.0 110.153 176.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -60.84 -49.07 78.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.346 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -67.94 -57.35 6.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.32 -177.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.454 ' HB3' ' CD1' ' A' ' 10' ' ' ILE . 5.4 p -62.17 -52.39 64.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.864 -172.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.43 -29.21 61.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -172.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.437 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 17.0 tpt180 -69.09 -29.58 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.95 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.31 -43.21 86.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 46' ' ' SER . 6.3 mp -74.8 -31.5 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.48 ' HA ' HD13 ' A' ' 20' ' ' LEU . 2.9 mm? -78.77 -7.68 58.03 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.098 0.406 . . . . 0.0 112.098 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.48 ' OD1' ' HD2' ' A' ' 22' ' ' PRO . 63.1 t30 -68.78 124.69 90.75 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.48 ' HD2' ' OD1' ' A' ' 21' ' ' ASN . 57.2 Cg_endo -70.46 46.68 0.61 Allowed 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 123.246 2.631 . . . . 0.0 114.553 -172.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -127.54 -4.66 5.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.102 0.477 . . . . 0.0 109.89 173.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -92.93 131.46 33.34 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.085 -176.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -86.31 162.64 9.82 Favored 'Trans proline' 0 C--O 1.239 0.559 0 C-N-CA 122.813 2.342 . . . . 0.0 111.776 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.626 ' HB2' ' HB2' ' A' ' 48' ' ' PHE . 3.2 ttm180 -60.96 117.87 6.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.18 -6.29 7.23 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.113 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.587 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 28.0 m -74.92 112.82 11.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 176.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.523 ' CG ' HD22 ' A' ' 98' ' ' LEU . 34.5 p90 -125.68 161.34 27.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.987 0.422 . . . . 0.0 111.839 -174.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.2 pt? -159.99 138.2 10.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.401 171.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.45 HG13 ' HA ' ' A' ' 6' ' ' TYR . 0.1 OUTLIER -98.97 114.76 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.463 0.649 . . . . 0.0 110.585 178.771 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 29.9 ptt180 -108.22 149.28 28.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.465 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.591 ' HG2' ' CE2' ' A' ' 41' ' ' TYR . 33.1 mt-10 -87.22 126.13 34.62 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 t -74.72 115.9 14.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.179 0.514 . . . . 0.0 110.103 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.29 -17.08 63.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.786 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.1 m -78.85 -34.76 44.79 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.281 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.7 m -136.67 113.56 10.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.957 0.408 . . . . 0.0 110.928 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -70.51 121.72 18.33 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.033 0.444 . . . . 0.0 110.638 -178.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.668 ' HA3' ' HD2' ' A' ' 63' ' ' LYS . . . 102.05 -4.86 52.66 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.016 -178.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.42 113.3 26.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.082 0.468 . . . . 0.0 110.169 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.782 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 69.1 m-85 -102.4 141.32 35.41 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.598 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 56.7 m -103.2 103.91 14.0 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.654 ' HB3' ' HB2' ' A' ' 59' ' ' TYR . 2.4 tm? -79.67 86.9 5.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 172.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.2 m -84.81 114.78 22.33 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.001 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.92 136.55 50.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.938 0.399 . . . . 0.0 110.244 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.519 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 t -78.16 115.45 17.9 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.591 0.71 . . . . 0.0 109.2 172.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -110.25 136.85 48.8 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.445 -1.252 . . . . 0.0 108.982 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 26' ' ' ARG . 56.6 t80 -82.02 126.38 31.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.985 0.421 . . . . 0.0 110.4 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -117.54 146.66 43.42 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.3 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.27 -13.9 56.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.839 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.26 -41.19 3.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.815 0.341 . . . . 0.0 110.792 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -85.91 -24.51 26.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.94 -73.14 1.99 Allowed Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -175.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.08 132.7 49.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -132.4 140.38 48.44 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 60.2 t -92.71 109.29 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.25 0.548 . . . . 0.0 110.347 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.435 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 34.9 ttmt -92.26 105.21 17.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.74 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -86.6 107.93 18.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.063 -177.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.654 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 99.1 m-85 -86.11 121.79 29.21 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -83.49 109.77 17.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.615 0.721 . . . . 0.0 111.412 -177.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.782 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 72.0 mt -86.95 99.93 9.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.545 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -95.33 146.99 23.97 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.511 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.668 ' HD2' ' HA3' ' A' ' 39' ' ' GLY . 0.1 OUTLIER -92.74 139.08 30.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.244 0.545 . . . . 0.0 109.914 177.623 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.442 HD11 ' NE2' ' A' ' 76' ' ' GLN . 13.9 mt -84.17 159.5 21.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.768 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -74.85 74.3 2.12 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.842 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.8 m 81.82 26.93 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.893 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.11 -38.87 1.46 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.877 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 145.39 -139.1 8.08 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 121.236 -0.506 . . . . 0.0 111.917 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -129.08 145.94 51.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -150.92 139.33 20.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.173 0.511 . . . . 0.0 111.507 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.538 HD12 ' CE2' ' A' ' 87' ' ' TYR . 33.0 mt -89.04 -30.37 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.913 0.864 . . . . 0.0 108.965 170.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -136.88 144.97 43.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.067 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.6 p -66.53 -11.04 50.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.238 -173.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.1 ptm180 -85.64 -20.7 29.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.041 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 m -135.69 112.27 10.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 0.0 111.327 -174.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.442 ' NE2' HD11 ' A' ' 64' ' ' LEU . 62.8 mt-30 -115.55 143.93 44.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.668 -176.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.418 ' HZ ' ' CD2' ' A' ' 86' ' ' TYR . 94.7 m-85 -126.97 162.73 25.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.116 177.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 t -86.72 -29.98 22.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.852 -0.158 . . . . 0.0 111.305 -177.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 88.3 p -143.81 167.77 21.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.619 0.247 . . . . 0.0 110.703 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 83' ' ' LEU . 2.6 mm? -65.47 -26.4 67.92 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.8 0.333 . . . . 0.0 111.161 177.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.32 -43.16 91.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.429 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -70.1 -31.0 68.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 2.2 tm? -55.78 -68.23 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.699 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.96 -41.67 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -173.587 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.98 -27.89 47.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.039 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.418 ' CD2' ' HZ ' ' A' ' 77' ' ' PHE . 85.5 t80 -84.24 -52.39 6.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.85 178.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.538 ' CE2' HD12 ' A' ' 71' ' ' ILE . 22.5 m-85 -65.37 -15.91 63.06 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.629 -175.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.643 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.9 t -66.23 -32.02 73.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.007 0.432 . . . . 0.0 110.441 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.488 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 73.3 mmtt -113.59 -41.01 3.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.849 -176.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.534 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 13.1 m-70 -120.99 110.17 15.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -72.41 -39.25 68.07 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.98 -176.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 65.36 -75.52 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.628 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.79 -34.8 4.52 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.593 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -58.42 142.09 49.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.307 0.575 . . . . 0.0 111.238 176.18 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 20.7 m -74.45 -24.99 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.875 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -137.38 147.95 45.87 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.664 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 89' ' ' LYS . 40.3 mtm180 -84.71 135.77 34.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.037 -177.335 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 81.7 mt -55.8 110.35 0.71 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.905 0.384 . . . . 0.0 110.537 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -94.92 -63.25 1.19 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.386 -174.071 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -134.74 146.93 49.87 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.404 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.5 t -83.37 153.39 3.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.014 -178.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.3 t -59.28 136.52 88.56 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.668 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.7 Cg_exo -65.68 146.11 83.2 Favored 'Trans proline' 0 C--N 1.347 0.447 0 C-N-CA 123.012 2.474 . . . . 0.0 111.553 175.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.667 -177.486 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 120.43 0.157 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -57.27 -52.67 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.04 0.448 . . . . 0.0 110.434 174.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -71.61 -35.97 70.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.946 -177.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.437 ' HA ' HG13 ' A' ' 31' ' ' VAL . 39.3 t80 -89.41 101.06 13.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.889 0.376 . . . . 0.0 110.793 -176.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.476 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 15.5 m-85 -84.37 -33.62 23.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.369 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 124.83 -166.8 17.36 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.321 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.829 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 14.1 pttp -89.5 59.28 4.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.877 0.846 . . . . 0.0 111.229 -178.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.1 pt -76.42 149.21 6.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.671 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 47.2 p -82.35 167.75 18.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -61.84 -38.55 88.62 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.621 -177.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -41.29 68.6 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.232 0.539 . . . . 0.0 110.694 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -78.49 -47.59 17.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.491 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -61.35 -48.43 81.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.477 -176.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.62 -32.37 69.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.021 -176.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -60.05 -30.57 69.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.95 -40.39 28.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.095 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 30' ' ' LEU . 74.5 mt -81.96 -23.11 36.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.8 mm? -85.22 42.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.338 0.589 . . . . 0.0 111.261 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -104.62 128.78 26.19 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 169.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.665 ' HA ' HD11 ' A' ' 54' ' ' LEU . 11.9 Cg_endo -55.23 -22.15 31.43 Favored 'Trans proline' 0 N--CA 1.473 0.306 0 C-N-CA 123.495 2.797 . . . . 0.0 114.549 -170.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -98.74 23.75 8.39 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.852 -177.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 14.6 m-80 -78.17 115.46 51.03 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 120.853 0.359 . . . . 0.0 110.045 173.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 21.5 Cg_exo -65.35 154.32 74.16 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.907 2.405 . . . . 0.0 111.956 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -66.16 109.1 2.49 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.484 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.91 22.55 5.62 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.544 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 61.5 m -83.73 124.38 30.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 175.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.473 ' CG ' HD22 ' A' ' 98' ' ' LEU . 29.5 p90 -133.29 161.62 34.0 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.92 138.23 9.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.788 170.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.471 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.1 p -103.47 118.91 51.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.666 0.746 . . . . 0.0 110.855 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 19.0 ptt85 -112.67 148.81 33.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.443 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.829 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 35.0 tt0 -83.93 134.99 34.64 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 37' ' ' THR . 38.0 m -73.75 130.06 39.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.434 0.635 . . . . 0.0 111.565 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -79.36 -18.7 51.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.488 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.2 p -119.89 9.22 11.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 34' ' ' SER . 78.9 m -153.79 124.63 7.25 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.758 0.313 . . . . 0.0 110.653 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -103.64 138.87 39.7 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.789 0.328 . . . . 0.0 110.131 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.31 9.38 56.88 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -175.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -150.44 120.75 7.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.938 0.399 . . . . 0.0 110.392 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 57.0 m-85 -101.3 165.01 11.5 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.454 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 32.4 t -117.47 111.64 19.56 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.744 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.471 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.3 tm? -90.71 87.03 6.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.4 m -78.28 122.09 25.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.869 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 p -118.67 138.43 49.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.96 0.41 . . . . 0.0 110.331 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -94.19 128.96 40.93 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.604 0.716 . . . . 0.0 110.063 179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -112.16 133.23 54.42 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.519 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -105.97 112.52 25.61 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.457 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -118.59 147.74 43.4 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.469 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -79.58 -13.36 59.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.719 -174.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.21 -44.0 2.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 111.246 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -81.4 -20.59 40.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.064 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 85.94 -133.11 11.55 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.98 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.665 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.0 mt -96.84 109.65 22.31 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.146 0.498 . . . . 0.0 110.284 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -105.87 116.52 32.08 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.009 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 82.7 t -91.62 107.8 19.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.151 0.5 . . . . 0.0 109.937 178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -95.31 114.52 26.31 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.216 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -89.56 87.11 6.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.537 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.449 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 76.8 m-85 -76.46 157.38 32.25 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -123.04 120.6 33.81 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.22 0.533 . . . . 0.0 111.51 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.615 HG12 HG12 ' A' ' 71' ' ' ILE . 52.8 mt -89.8 88.24 2.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.782 176.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -93.71 154.46 17.78 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.504 -174.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 21.4 pttp -109.8 142.6 40.83 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.105 0.479 . . . . 0.0 110.214 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.483 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 45.2 mt -78.97 175.01 10.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.801 177.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -62.06 -46.27 89.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.705 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.9 t -153.28 58.71 0.77 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -140.59 -33.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.839 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 121.73 -158.97 16.41 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.248 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.67 147.84 25.54 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.448 0.299 . . . . 0.0 110.389 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.483 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 44.9 p90 -156.04 143.23 19.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.602 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.705 HG21 HD11 ' A' ' 94' ' ' LEU . 62.0 mt -83.86 -29.78 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.578 0.704 . . . . 0.0 109.134 173.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.459 HG21 ' HA3' ' A' ' 93' ' ' GLY . 11.5 t -146.12 161.06 41.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.472 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.8 p -78.07 59.34 2.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.986 0.422 . . . . 0.0 111.304 -177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -132.04 -78.98 0.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.37 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.8 m -100.67 122.42 43.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.335 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -104.17 147.11 27.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.262 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.587 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 95.9 m-85 -132.02 142.25 49.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 121.343 0.592 . . . . 0.0 111.391 -178.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -72.67 -21.3 61.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.517 -177.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.1 p -141.34 172.66 12.37 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.82 0.343 . . . . 0.0 111.231 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 85.7 mt -79.52 -28.19 41.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.712 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -64.9 -43.7 92.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 77' ' ' PHE . 76.7 mt-30 -60.76 -36.76 79.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.393 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 71' ' ' ILE . 3.2 tm? -55.75 -67.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.564 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.415 ' H ' HG22 ' A' ' 84' ' ' VAL . 0.2 OUTLIER -62.9 -41.47 92.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -175.434 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.94 -34.92 66.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.79 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.976 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.764 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 34.9 m-85 -70.93 -7.75 48.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.373 -176.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.585 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.9 t -71.31 -23.04 61.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.188 0.518 . . . . 0.0 110.08 173.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -116.05 -45.75 2.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.177 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.764 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 24.9 m-70 -111.06 116.67 31.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.049 177.123 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.58 -24.51 64.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.529 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 35.3 t70 62.63 -81.8 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.612 0.765 . . . . 0.0 112.072 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.459 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -101.53 -33.26 4.85 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.743 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.705 HD11 HG21 ' A' ' 71' ' ' ILE . 4.0 mp -71.0 171.05 11.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.052 0.453 . . . . 0.0 110.329 175.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' CYS . . . . . 0.437 ' HG ' ' CE1' ' A' ' 96' ' ' HIS . 5.5 p -114.3 12.74 17.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.455 0.645 . . . . 0.0 109.514 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 95' ' ' CYS . 79.2 m80 -128.26 118.15 22.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.001 -0.999 . . . . 0.0 109.756 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 97' ' ' ARG . 33.5 mtt180 -75.66 133.6 40.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 64.8 mt -66.49 88.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.4 m -88.49 -57.5 2.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.439 -171.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.5 p-10 -130.64 145.2 51.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.824 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.88 158.4 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.842 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.3 t -56.4 133.64 76.48 Favored Pre-proline 0 C--N 1.327 -0.396 0 O-C-N 123.498 0.499 . . . . 0.0 111.292 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.34 154.56 56.17 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.697 2.265 . . . . 0.0 112.019 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.513 179.98 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.04 -50.11 28.96 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 123.62 0.575 . . . . 0.0 112.101 -172.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.491 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 4.6 p-90 -77.94 -31.23 50.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.358 -174.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.491 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 63.4 t80 -91.11 106.33 18.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.789 0.328 . . . . 0.0 111.082 -174.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 43.8 m-85 -94.55 15.32 18.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.511 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 81.79 -131.09 10.14 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.552 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -122.54 115.73 22.68 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.671 0.748 . . . . 0.0 110.033 176.59 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 14' ' ' GLU . 35.1 pt -131.85 154.08 39.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.045 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.7 p -96.9 179.85 4.81 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.549 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 12' ' ' ARG . 8.2 ptm180 -54.51 -32.04 57.3 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.191 0.307 . . . . 0.0 111.232 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 59.9 ttp180 -59.72 -51.79 68.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.902 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.566 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 11.8 mp0 -72.68 -45.81 57.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.934 0.397 . . . . 0.0 110.458 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.9 t -59.73 -66.87 0.45 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.959 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.06 -23.1 65.2 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -177.495 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -62.66 -42.44 99.62 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.2 0.524 . . . . 0.0 109.963 178.523 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.8 mt -80.89 -39.57 26.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.878 -177.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 30' ' ' LEU . 62.4 mt -79.45 -35.22 40.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.267 -172.441 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 3.9 mm? -83.21 14.18 3.68 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.177 0.513 . . . . 0.0 110.524 177.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -92.82 107.19 22.61 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 172.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -72.63 49.17 1.44 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.327 2.685 . . . . 0.0 114.416 -169.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -119.63 4.72 11.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.345 0.593 . . . . 0.0 109.839 172.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -104.59 144.25 28.33 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.339 -178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -84.61 168.7 11.11 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 123.156 2.571 . . . . 0.0 112.054 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -63.96 129.23 39.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.949 0.404 . . . . 0.0 110.834 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.19 3.67 31.24 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.213 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.508 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 85.4 m -72.33 109.15 5.86 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.902 -0.406 . . . . 0.0 109.902 175.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.472 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.5 p90 -126.83 161.31 28.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 111.621 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.59 143.64 13.26 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.41 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -107.78 122.13 61.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.69 0.757 . . . . 0.0 110.905 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.44 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 16.1 ptt180 -117.19 142.07 47.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.228 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -81.92 121.5 26.57 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.807 ' HB2' HG22 ' A' ' 37' ' ' THR . 4.2 m -77.54 113.15 15.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.686 0.279 . . . . 0.0 110.304 -177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -70.54 -3.83 19.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.862 0.363 . . . . 0.0 111.477 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.7 t -95.63 9.19 41.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.139 0.495 . . . . 0.0 110.7 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.96 HG21 ' HB3' ' A' ' 40' ' ' ALA . 11.1 t -150.14 169.78 20.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.734 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -123.67 30.08 6.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.558 0.694 . . . . 0.0 110.736 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.459 ' HA2' ' HE2' ' A' ' 63' ' ' LYS . . . 171.2 44.18 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.801 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.96 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -152.34 101.44 2.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.146 0.498 . . . . 0.0 110.614 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 41.9 m-85 -90.71 149.37 22.08 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.82 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.0 m -108.92 106.48 16.48 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.694 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.475 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -84.41 88.2 7.27 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m -85.5 108.75 18.07 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.357 -176.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.2 p -107.89 124.56 64.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.336 0.589 . . . . 0.0 110.653 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.6 t -79.39 129.81 34.82 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.138 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.34 115.65 13.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.136 -176.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -83.45 83.97 7.69 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 170.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -71.21 110.31 5.78 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.03 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -74.19 73.65 1.77 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.203 0.525 . . . . 0.0 110.552 -172.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.82 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.938 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -121.93 -34.57 3.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.709 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.77 -148.45 16.86 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.648 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -75.51 114.93 14.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.0 111.67 -177.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -126.13 117.39 23.04 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 91.9 t -88.93 106.2 16.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -84.23 102.26 12.5 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.12 -175.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 32' ' ' ARG . 15.2 m-70 -80.98 93.89 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.914 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.691 ' HB3' HG23 ' A' ' 71' ' ' ILE . 57.4 m-85 -77.13 124.62 28.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.119 0.485 . . . . 0.0 110.025 177.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -88.23 110.9 21.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.07 -170.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.718 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 54.4 mt -91.45 94.25 4.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.793 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.2 ttp180 -92.01 157.07 16.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.745 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' ' HA2' ' A' ' 39' ' ' GLY . 43.5 mtmt -97.88 147.23 24.65 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.624 0.726 . . . . 0.0 112.168 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.477 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 87.1 mt -115.84 130.55 56.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.332 -1.303 . . . . 0.0 109.212 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -72.54 -22.6 60.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.938 0.399 . . . . 0.0 110.482 -178.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 p -113.89 30.97 6.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.789 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.41 -94.08 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.325 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.477 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 173.52 -134.01 2.77 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.828 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -99.26 137.02 38.36 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' A' ' 61' ' ' ILE . 25.8 p90 -144.11 140.46 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.167 0.508 . . . . 0.0 110.839 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 59.2 mt -87.0 -35.37 8.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.781 174.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.2 t -143.63 159.75 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.452 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -75.88 57.28 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.507 0.67 . . . . 0.0 110.739 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -130.74 -64.45 0.83 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.773 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.2 m -134.47 123.01 23.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.698 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -115.29 144.06 44.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.679 0.276 . . . . 0.0 110.831 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -127.62 147.3 50.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 p -83.35 10.5 8.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.126 0.489 . . . . 0.0 111.125 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLN . 30.0 m -148.65 135.23 19.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.773 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.634 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.9 mt -63.25 -35.2 79.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.647 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -61.73 -46.06 91.26 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.713 0.292 . . . . 0.0 110.819 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.405 ' HG2' ' HB2' ' A' ' 79' ' ' SER . 13.9 mm100 -61.34 -38.63 87.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.821 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -58.42 -64.14 1.03 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.994 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.9 m -63.51 -45.31 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.61 -33.64 68.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -78.12 -46.3 21.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.832 0.349 . . . . 0.0 110.462 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-85 -73.11 -7.33 50.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.442 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.601 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 28.0 t -74.67 -15.92 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.281 0.562 . . . . 0.0 109.851 174.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -120.58 -51.42 2.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.626 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.0 t-80 -103.4 107.06 17.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.76 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 66.92 -65.48 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.071 0.548 . . . . 0.0 112.458 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -125.6 -30.93 0.86 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.952 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.581 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.3 mp -64.92 148.28 51.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.281 0.562 . . . . 0.0 111.183 178.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 62.2 m -78.4 -6.97 56.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.933 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -152.71 144.33 23.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -67.62 145.62 54.67 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.91 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 87.5 mt -64.79 95.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.7 m -90.34 -60.5 1.91 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.754 -171.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.8 p-10 -131.66 141.19 49.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -176.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -80.87 149.95 4.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.7 t -56.7 117.95 20.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 2.7 Cg_exo -75.18 147.37 33.17 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.912 2.408 . . . . 0.0 110.712 173.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 C--N 1.321 -0.642 0 CA-C-O 121.167 0.508 . . . . 0.0 110.793 -178.603 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -98.89 -54.99 2.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.273 0.558 . . . . 0.0 110.063 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.436 ' HE3' ' CG1' ' A' ' 31' ' ' VAL . 5.3 p-90 -68.6 -28.73 67.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.854 -176.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.421 ' HA ' HG13 ' A' ' 31' ' ' VAL . 23.9 t80 -80.89 125.93 30.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.199 -178.194 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 16.9 m-85 -118.62 34.6 5.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.043 0.449 . . . . 0.0 111.9 -178.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.5 -141.52 35.43 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.934 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 33.0 mtmm -117.98 48.34 1.41 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.74 0.305 . . . . 0.0 111.22 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 pt -67.81 151.32 10.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.56 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.3 p -80.62 172.46 13.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.203 -178.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -59.77 -48.22 82.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 110.283 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.8 -47.5 77.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.137 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.2 -41.13 97.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.931 0.396 . . . . 0.0 110.826 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 22.7 t -62.95 -48.15 80.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.283 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HB3' HD23 ' A' ' 20' ' ' LEU . 61.3 mt-10 -69.74 -27.91 65.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.357 -178.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -60.74 -30.19 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.224 0.535 . . . . 0.0 110.374 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.14 -28.49 18.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.469 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.563 HD21 HD22 ' A' ' 30' ' ' LEU . 83.3 mt -93.83 -34.23 13.24 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.1 mm? -79.17 49.43 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.481 0.658 . . . . 0.0 111.179 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -125.23 112.81 26.18 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.82 41.76 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.998 2.465 . . . . 0.0 113.326 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -128.45 9.44 6.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.931 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -110.5 149.88 40.87 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.681 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -82.92 157.68 15.62 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.81 2.34 . . . . 0.0 112.158 176.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -62.94 140.07 58.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 120.898 0.38 . . . . 0.0 110.396 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.97 2.43 59.43 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.39 -0.909 . . . . 0.0 111.667 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.712 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 65.3 m -73.2 110.79 7.76 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.583 ' CG ' HD22 ' A' ' 98' ' ' LEU . 27.0 p90 -127.35 158.07 38.24 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.124 0.487 . . . . 0.0 111.586 -172.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.588 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.6 pt? -152.24 132.86 13.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.504 170.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 5' ' ' TRP . 2.6 p -103.1 114.27 42.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.964 -177.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 24.4 ptt85 -109.1 144.16 37.5 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.07 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.685 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 36.6 tt0 -83.36 138.21 33.62 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.131 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 45.4 t -88.01 138.15 31.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.336 0.589 . . . . 0.0 111.686 -175.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -93.34 -15.85 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.307 175.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.3 p -98.96 -5.56 30.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -173.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.447 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 17.6 m -148.69 131.63 16.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.714 0.292 . . . . 0.0 110.734 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.98 121.33 26.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.47 -178.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.72 31.23 36.87 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.143 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -130.45 128.84 42.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.92 0.39 . . . . 0.0 110.241 178.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -119.86 147.67 44.41 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.81 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 35.4 m -105.15 94.75 5.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.529 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.7 tm? -77.93 88.86 4.1 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 174.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.6 m -87.27 114.84 24.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.488 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -120.25 141.2 41.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.086 0.469 . . . . 0.0 111.124 -176.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.0 t -84.15 129.36 34.9 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.801 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 25.5 t0 -123.61 61.12 1.07 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.435 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.71 111.44 3.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.381 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 52' ' ' LYS . 9.9 t70 -114.97 144.12 44.09 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.448 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -75.06 -12.44 60.32 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.927 -170.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -104.27 -44.22 5.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.856 0.36 . . . . 0.0 111.304 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.515 ' HG2' ' OD2' ' A' ' 49' ' ' ASP . 6.6 ptpp? -101.19 -9.0 21.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.19 0.519 . . . . 0.0 111.575 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.49 -148.71 19.73 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.544 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 86.0 mt -80.73 114.6 19.73 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.41 0.284 . . . . 0.0 111.129 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.547 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 9.7 m120 -115.13 124.05 50.52 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.622 HG21 HD22 ' A' ' 20' ' ' LEU . 79.8 t -111.59 114.66 47.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.211 0.529 . . . . 0.0 110.373 177.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -97.81 105.59 17.76 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.106 -176.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -81.61 83.9 6.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -67.34 127.07 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.29 0.567 . . . . 0.0 111.864 -176.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -82.04 96.1 7.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.485 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.704 HD11 ' HB2' ' A' ' 43' ' ' LEU . 58.6 mt -74.92 97.72 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 175.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -91.4 137.8 32.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.383 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' PHE . 51.2 pttt -91.83 151.57 20.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.253 0.549 . . . . 0.0 109.983 174.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.43 157.51 20.46 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 168.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -51.32 -44.08 61.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.3 m -67.51 -26.84 66.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 123.02 42.74 0.39 Allowed Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.37 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.61 108.66 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.917 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 63' ' ' LYS . 84.7 m-85 -84.97 130.13 34.68 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -143.12 143.25 31.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.394 0.616 . . . . 0.0 111.306 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 70.8 mt -92.4 -39.44 11.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.469 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.8 t -114.78 147.89 39.15 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.813 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.0 p -67.81 -7.24 26.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 74' ' ' ARG . 63.7 mtt180 -83.74 -57.61 3.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.904 0.383 . . . . 0.0 110.812 178.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 86' ' ' TYR . 1.3 m -101.68 104.82 15.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.812 -171.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -113.96 133.87 55.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.668 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 83' ' ' LEU . 83.8 m-85 -124.49 146.6 48.87 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.2 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.4 t -88.23 -2.39 58.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 45.5 m -144.03 137.35 27.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.054 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.538 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.9 mt -65.38 -23.46 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -56.52 -47.72 78.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.297 0.57 . . . . 0.0 110.204 174.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -73.36 -27.2 61.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.638 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 3.4 tm? -59.12 -64.74 0.83 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.262 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.25 -44.31 97.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.755 -176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.76 -42.27 62.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.032 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.415 ' CD2' HG21 ' A' ' 75' ' ' THR . 91.2 t80 -78.14 -43.05 29.91 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.641 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -69.84 -12.34 61.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.665 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.475 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 50.0 m -72.63 -22.36 60.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.274 0.559 . . . . 0.0 110.096 173.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -104.59 -44.47 4.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.643 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.641 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 31.6 m-70 -125.5 114.81 19.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -76.39 -40.71 50.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.69 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.469 ' HB3' HG21 ' A' ' 72' ' ' THR . 12.2 t70 65.42 -76.32 0.04 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.732 177.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.03 -40.42 8.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.209 -0.52 . . . . 0.0 112.156 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.649 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.5 mp -67.4 150.15 49.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.061 0.457 . . . . 0.0 110.47 178.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 32.6 t -72.68 -18.03 61.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.558 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -149.79 139.68 21.89 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.625 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 32.7 ptt85 -73.58 158.18 35.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.093 0.473 . . . . 0.0 111.515 -176.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.583 HD22 ' CG ' ' A' ' 29' ' ' PHE . 59.6 mt -66.52 101.3 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.062 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.8 m -97.65 -41.5 8.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.636 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.712 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.0 t30 -141.65 132.74 26.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.026 0.441 . . . . 0.0 110.511 -175.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.4 t -81.06 139.39 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.458 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.0 t -53.65 118.76 15.82 Favored Pre-proline 0 C--N 1.33 -0.251 0 O-C-N 123.507 0.504 . . . . 0.0 111.135 -176.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.73 151.96 46.98 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.469 2.113 . . . . 0.0 111.558 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 C--N 1.322 -0.625 0 CA-C-O 120.943 0.401 . . . . 0.0 110.07 176.739 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.43 -28.51 13.18 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.538 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.79 ' HA ' HG11 ' A' ' 101' ' ' VAL . 15.3 p-90 -82.03 -28.72 32.35 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -99.59 110.15 22.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.118 0.485 . . . . 0.0 110.612 -174.668 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -98.94 -0.9 41.27 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.0 -156.6 23.75 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.193 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -86.47 61.35 6.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.396 0.617 . . . . 0.0 111.547 -177.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.557 HD11 HD13 ' A' ' 30' ' ' LEU . 46.3 pt -74.47 138.0 21.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 174.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.6 p -72.94 159.73 33.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 15' ' ' SER . 10.2 ptm180 -67.2 -23.54 65.75 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.883 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 23.2 tpt180 -61.89 -39.0 90.43 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.96 -35.42 64.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.791 176.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.523 ' HB3' ' HA ' ' A' ' 12' ' ' ARG . 29.0 t -60.52 -67.21 0.42 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.981 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.437 ' OE2' ' HB2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -54.48 -38.85 66.9 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.739 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -57.15 -39.46 75.27 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -177.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.0 mt -86.6 -34.89 19.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.6 mt -81.07 -17.96 48.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.215 -174.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.54 14.08 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.591 0.234 . . . . 0.0 111.567 177.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.571 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 21.5 t30 -67.77 120.14 71.45 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -57.35 -20.78 41.35 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.043 2.495 . . . . 0.0 113.302 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -98.47 21.1 11.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.858 0.361 . . . . 0.0 111.472 -178.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.571 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 94.5 m-20 -89.82 118.21 68.76 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 170.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.91 144.3 64.02 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.152 1.901 . . . . 0.0 111.489 175.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.45 ' HB2' ' HB3' ' A' ' 48' ' ' PHE . 41.0 ttp180 -56.41 110.68 0.81 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.109 177.349 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.16 -0.6 7.08 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.644 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 37.1 m -77.36 129.05 35.31 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 28.6 p90 -139.39 171.25 14.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.151 0.5 . . . . 0.0 111.959 -173.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.557 HD13 HD11 ' A' ' 10' ' ' ILE . 3.4 pp -158.17 149.2 20.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.513 166.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.6 p -108.07 120.65 59.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.746 0.784 . . . . 0.0 110.814 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.687 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.8 145.95 37.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.279 -179.324 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -89.63 131.89 35.4 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.319 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.8 t -104.64 107.71 18.79 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -75.66 -3.04 32.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.965 0.412 . . . . 0.0 111.315 -173.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -42.64 87.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.33 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 29.6 m -121.19 127.55 51.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.356 -177.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -79.12 74.26 5.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.419 0.628 . . . . 0.0 110.366 -177.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.554 ' HA2' ' HE3' ' A' ' 63' ' ' LYS . . . 139.52 27.08 0.25 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.202 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -138.86 97.65 3.37 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.174 0.511 . . . . 0.0 110.457 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.774 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.7 m-85 -90.7 169.81 10.67 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.376 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.687 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -128.55 110.56 12.38 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.6 tm? -89.68 93.52 9.5 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 175.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 38.0 m -84.49 105.42 15.29 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -104.4 135.03 44.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 t -75.89 125.59 29.39 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.534 0.683 . . . . 0.0 110.467 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -105.94 133.04 51.29 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.173 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.523 ' HA ' ' O ' ' A' ' 53' ' ' GLY . 55.7 t80 -141.73 114.6 8.57 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.761 0.791 . . . . 0.0 112.679 -171.059 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.888 ' HB3' ' HA3' ' A' ' 53' ' ' GLY . 0.6 OUTLIER -84.75 142.31 29.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.862 165.341 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -58.91 -12.73 4.84 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -166.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -129.02 -54.32 1.2 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -117.85 -11.18 10.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -166.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.888 ' HA3' ' HB3' ' A' ' 49' ' ' ASP . . . -102.42 58.26 0.59 Allowed Glycine 0 C--O 1.225 -0.411 0 C-N-CA 119.807 -1.187 . . . . 0.0 115.394 -163.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 12.5 mt -90.47 131.4 36.24 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.932 0.866 . . . . 0.0 110.538 171.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -175.85 166.89 3.1 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.8 t -102.92 125.24 57.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 120.773 0.321 . . . . 0.0 110.176 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -99.22 101.44 12.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -82.19 104.06 12.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.334 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.401 ' HB3' HG23 ' A' ' 71' ' ' ILE . 54.2 m-85 -91.37 136.68 32.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.872 173.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -93.51 127.49 39.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.182 0.515 . . . . 0.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.774 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.6 mt -93.5 101.41 12.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.259 177.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.2 142.79 27.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.831 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HE3' ' HA2' ' A' ' 39' ' ' GLY . 26.0 ttpp -108.75 128.57 54.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.614 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.8 mt -75.81 150.69 37.65 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.876 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -53.06 -54.7 31.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.053 0.454 . . . . 0.0 111.406 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -129.87 45.69 2.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.208 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 -107.21 0.74 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.202 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -152.83 -151.11 5.59 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.778 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -110.15 141.82 42.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.769 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 46.4 p90 -147.38 137.59 23.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.161 0.505 . . . . 0.0 110.923 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.503 HG12 HG12 ' A' ' 61' ' ' ILE . 75.2 mt -84.65 -52.56 12.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -103.81 146.8 28.1 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.545 171.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.5 t -81.74 47.91 1.14 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.238 0.542 . . . . 0.0 111.02 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 73.3 mtp180 -135.37 -57.73 0.79 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.918 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 31.0 m -105.23 116.79 32.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.769 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 8.4 pt20 -133.73 148.51 51.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.259 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.52 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 96.1 m-85 -131.79 143.38 50.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.161 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.5 m -75.56 -5.1 43.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.5 m -140.88 144.12 35.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.248 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 84' ' ' VAL . 69.6 mt -68.26 -27.27 66.19 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.112 -176.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -54.28 48.9 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -59.38 -33.33 71.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.309 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' C ' ' A' ' 83' ' ' LEU . 3.4 tm? -58.51 -65.24 0.69 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.47 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.83 -44.92 96.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -175.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.32 -43.65 83.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.033 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -76.26 -36.18 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.416 -177.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 8.4 m-85 -79.88 0.18 32.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.92 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 50.2 m -67.64 -29.74 69.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.48 0.657 . . . . 0.0 109.47 173.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -115.72 -43.22 3.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.984 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.566 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 73.1 m80 -94.97 90.88 6.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.308 -178.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.704 ' HB2' ' HG3' ' A' ' 97' ' ' ARG . . . -66.12 -35.57 80.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.884 0.373 . . . . 0.0 110.195 177.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.86 -83.99 0.02 OUTLIER 'General case' 0 C--O 1.235 0.292 0 CA-C-N 114.788 -1.097 . . . . 0.0 111.908 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.24 -42.75 4.84 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.993 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.67 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -60.81 153.02 25.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.056 0.455 . . . . 0.0 110.964 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 25.3 p -88.13 -10.07 51.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.161 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -121.65 149.99 42.39 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.661 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.704 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -105.84 137.6 43.45 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.093 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.8 mt -68.62 87.17 0.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.175 0.512 . . . . 0.0 110.706 -177.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.7 m -80.41 -48.58 12.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.548 -173.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.502 ' O ' ' HA ' ' A' ' 28' ' ' THR . 15.0 p-10 -155.24 152.71 29.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.791 0.329 . . . . 0.0 110.26 -178.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.79 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -91.52 140.35 16.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.996 -176.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.94 125.49 92.01 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.275 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.99 159.27 44.95 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.796 2.331 . . . . 0.0 111.683 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.913 -175.397 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 CA--C 1.523 -0.066 0 CA-C-O 121.4 0.619 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -54.9 -43.98 73.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.613 -168.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -76.56 -38.49 54.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.409 ' HA ' HG13 ' A' ' 31' ' ' VAL . 37.0 t80 -86.34 107.21 17.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 0.0 111.053 -173.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.487 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 27.1 m-85 -97.88 14.41 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.361 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.02 -143.42 28.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.763 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -111.17 51.6 0.77 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.138 0.494 . . . . 0.0 111.26 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 pt -61.73 147.17 11.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.057 175.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.7 p -87.82 -175.96 5.33 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.587 -177.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -39.51 94.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.97 0.414 . . . . 0.0 110.7 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -55.07 -48.22 73.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.321 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.66 -55.31 15.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.552 -176.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.9 p -61.36 -56.76 16.74 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -172.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HB3' HD23 ' A' ' 20' ' ' LEU . 1.6 mp0 -66.62 -29.25 69.24 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -176.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -66.46 -25.26 66.64 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.935 -0.478 . . . . 0.0 110.481 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.7 mt -85.52 -38.75 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.97 0.414 . . . . 0.0 110.794 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.42 HD11 HD21 ' A' ' 30' ' ' LEU . 81.7 mt -82.06 -28.67 32.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.162 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 20' ' ' LEU . 4.0 mm? -78.89 52.35 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.997 0.427 . . . . 0.0 111.442 178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 51.3 m-80 -136.33 132.02 18.78 Favored Pre-proline 0 C--N 1.32 -0.713 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 15.3 Cg_exo -69.41 7.67 0.85 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.303 2.669 . . . . 0.0 112.4 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -94.36 -1.0 54.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.053 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -97.21 129.18 32.73 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.09 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.516 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 15.2 Cg_exo -66.24 138.68 52.21 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.279 1.986 . . . . 0.0 111.087 173.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HD3' ' H ' ' A' ' 48' ' ' PHE . 45.7 ttp180 -61.79 101.31 0.19 Allowed 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.85 -3.12 3.42 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.505 -171.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 89.1 m -69.77 117.47 11.41 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 122.452 0.301 . . . . 0.0 110.457 175.123 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 36.5 p90 -123.98 164.68 18.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.067 0.46 . . . . 0.0 111.821 -175.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.9 pt? -164.22 146.02 8.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.709 173.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.544 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -112.94 120.18 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.52 0.676 . . . . 0.0 111.347 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.536 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 27.4 ptt180 -107.17 150.98 26.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.169 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -92.45 142.59 27.26 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 175.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.2 t -72.36 123.54 23.26 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -76.88 -15.25 59.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.909 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -101.09 -21.78 14.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.906 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 23.8 m -130.23 121.0 25.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.059 0.457 . . . . 0.0 111.479 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -85.25 115.4 23.0 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 1.034 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 115.1 11.74 10.61 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.603 -175.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.03 129.16 23.68 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.006 0.431 . . . . 0.0 110.493 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.777 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 88.4 m-85 -120.25 179.67 4.22 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.066 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.536 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 61.5 m -139.09 100.11 3.94 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.688 0.28 . . . . 0.0 110.332 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.8 tm? -82.94 95.96 8.15 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 174.021 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.5 t -93.19 143.09 26.59 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.91 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.8 p -136.05 133.01 50.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.155 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -80.14 126.61 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.592 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.4 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 5.5 t70 -128.52 147.59 50.7 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.792 -178.546 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.453 ' H ' ' HD3' ' A' ' 26' ' ' ARG . 87.8 t80 -133.34 113.66 12.84 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.335 0.588 . . . . 0.0 110.698 178.17 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.537 ' HB3' ' HD3' ' A' ' 52' ' ' LYS . 11.6 m-20 -105.8 137.99 42.75 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.84 173.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -71.4 -9.13 57.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.353 -173.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.17 -21.59 9.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.537 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -103.2 -23.8 13.6 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.858 0.361 . . . . 0.0 111.315 -177.106 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.05 23.09 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.69 114.79 17.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.928 0.394 . . . . 0.0 110.489 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -108.72 120.18 41.73 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.058 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 74.2 t -92.04 107.09 18.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.035 0.445 . . . . 0.0 109.971 175.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -91.51 100.38 13.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.944 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -85.56 88.99 7.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.491 . . . . 0.0 110.471 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.589 ' HB3' HG23 ' A' ' 71' ' ' ILE . 87.7 m-85 -77.79 88.04 4.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.542 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 42' ' ' CYS . 22.2 pttp -62.75 132.26 51.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.231 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.777 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 70.5 mt -98.8 125.9 52.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.499 -176.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -109.27 137.52 47.03 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.333 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 1.034 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 23.1 mtpp -84.71 145.21 28.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.502 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.99 -6.69 48.92 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 168.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.498 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 10.2 t70 73.93 -55.57 0.66 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.649 178.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.0 m -105.94 24.98 11.49 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.949 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.62 -107.82 0.46 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.291 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -129.42 -157.04 9.04 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.205 -174.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -119.38 141.75 48.79 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -146.07 136.05 23.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.507 0.67 . . . . 0.0 111.6 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.756 HG12 HG12 ' A' ' 61' ' ' ILE . 69.9 mt -82.77 -48.3 17.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.13 173.185 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -118.53 150.78 39.05 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.904 176.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -81.1 51.53 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -135.96 -77.53 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.326 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.0 m -94.47 104.47 16.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.209 0.528 . . . . 0.0 110.01 178.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -110.7 150.21 29.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 -173.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -129.51 141.55 50.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.977 0.417 . . . . 0.0 110.916 -178.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.521 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 15.8 m -83.1 20.46 1.23 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.686 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.9 t -167.57 161.45 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.548 ' O ' HG22 ' A' ' 84' ' ' VAL . 58.5 mt -83.48 -34.38 25.39 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -171.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -43.62 80.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -57.39 -36.33 71.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.414 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -61.81 -62.48 1.77 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.65 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -63.61 -43.21 98.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.157 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.04 -45.13 79.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.75 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -75.24 -42.61 54.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.776 0.322 . . . . 0.0 110.994 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-30 -70.16 -4.15 20.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.509 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -29.39 65.76 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.332 0.587 . . . . 0.0 109.725 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -107.11 -48.02 3.56 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.704 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.628 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.9 m-70 -107.24 102.41 11.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.276 -179.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -68.42 -37.08 79.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.814 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 t70 68.39 -71.63 0.11 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.69 175.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.44 -39.23 3.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.127 -0.558 . . . . 0.0 111.86 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.658 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -63.04 146.54 53.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.876 0.369 . . . . 0.0 110.68 176.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.1 -15.6 56.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.335 177.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -133.42 135.31 44.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.661 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -85.1 152.41 23.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.034 0.445 . . . . 0.0 110.63 -179.179 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 56.6 mt -67.56 101.83 1.06 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.959 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.2 m -91.58 -62.84 1.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.2 p-10 -133.67 147.92 51.45 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -177.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.537 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.3 t -91.13 151.75 3.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.251 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 52.4 t -57.97 124.71 70.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.016 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 9.2 Cg_endo -89.76 178.14 2.44 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 123.39 2.726 . . . . 0.0 112.277 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.4 p . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.434 178.021 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.499 ' HB2' ' CB ' ' A' ' 6' ' ' TYR . 5.9 mm-40 . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.451 ' O ' HG11 ' A' ' 101' ' ' VAL . 28.5 mm-40 -55.0 -29.69 57.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.504 -172.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.408 ' HE3' HG11 ' A' ' 31' ' ' VAL . 9.0 p-90 -96.14 -33.94 11.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CB ' ' HB2' ' A' ' 3' ' ' GLU . 9.8 t80 -79.54 93.64 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.796 -174.196 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.448 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.9 m-85 -80.74 -21.48 41.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.115 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.57 -158.05 27.11 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.596 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.578 ' HG2' ' HB2' ' A' ' 33' ' ' GLU . 66.5 mttm -79.26 55.14 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.6 pt -78.18 153.69 5.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -83.96 154.14 23.5 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.785 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 13' ' ' ARG . 17.8 ptt85 -56.94 -40.07 75.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -170.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.432 ' N ' ' HG3' ' A' ' 12' ' ' ARG . 22.3 tpp180 -60.54 -35.01 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.63 0.253 . . . . 0.0 110.72 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 46.7 mt-10 -65.56 -40.25 92.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.229 177.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.6 m -66.58 -47.6 72.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.269 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.24 -40.17 96.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.639 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -57.64 -31.99 66.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.277 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 92.0 mt -84.86 -39.66 18.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.397 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 30' ' ' LEU . 60.2 mt -80.77 -27.93 36.58 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.481 HD12 HD13 ' A' ' 54' ' ' LEU . 3.8 mm? -79.83 50.71 1.21 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.669 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -135.99 139.23 29.75 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.49 14.41 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.202 2.601 . . . . 0.0 112.843 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -97.32 -1.74 43.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.44 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 41.2 m-80 -110.34 112.76 56.84 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.358 -177.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 30.2 Cg_endo -65.36 157.0 60.27 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.53 2.153 . . . . 0.0 111.432 175.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -63.13 99.76 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.98 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 138.32 -0.66 2.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.072 -174.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 59.7 m -72.38 124.68 25.64 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 31.7 p90 -132.15 166.07 22.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.14 0.495 . . . . 0.0 112.127 -173.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.516 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -160.3 143.51 13.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.713 170.342 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.454 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.1 p -107.12 115.44 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.636 0.731 . . . . 0.0 111.171 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 1.6 ptm180 -104.05 157.4 17.14 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.812 177.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.578 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 49.5 mt-10 -96.31 137.68 35.03 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 174.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -82.81 118.11 23.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.604 0.716 . . . . 0.0 109.398 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -62.57 -40.18 96.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.996 -178.741 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -84.98 -65.87 0.96 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.323 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.2 m -77.68 92.09 4.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.439 0.637 . . . . 0.0 110.567 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -82.32 151.98 26.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.756 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.462 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 82.67 14.43 75.78 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -172.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -149.49 113.83 5.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.968 0.413 . . . . 0.0 110.173 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.824 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 22.9 m-85 -92.62 175.41 6.83 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.543 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 43.8 t -135.31 102.93 5.32 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.206 -178.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.454 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -85.62 91.34 8.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 m -86.65 121.23 28.88 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.08 -179.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.9 p -118.72 138.38 49.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.132 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -78.88 120.34 23.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.795 0.807 . . . . 0.0 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 9.5 t70 -107.26 76.06 1.06 Allowed 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.024 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.575 ' HA ' ' HA ' ' A' ' 54' ' ' LEU . 74.3 t80 -77.54 95.15 4.45 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.54 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -95.92 154.95 16.96 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.211 -177.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -84.15 -16.29 44.08 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.355 -173.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.99 -43.74 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.75 0.31 . . . . 0.0 111.165 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -82.69 -37.26 25.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.051 0.453 . . . . 0.0 110.818 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 108.61 -162.85 12.82 Favored Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 -176.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -79.61 104.99 10.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.676 0.751 . . . . 0.0 111.759 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.628 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 10.1 m-80 -102.14 157.18 17.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.322 178.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.0 t -112.79 115.56 50.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.143 0.497 . . . . 0.0 110.259 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -93.52 109.15 20.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.601 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -89.31 98.7 11.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.855 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -92.58 103.45 15.85 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -69.69 125.71 27.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.327 0.584 . . . . 0.0 111.048 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.824 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -91.97 93.9 4.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.38 155.18 23.64 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.023 -173.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 59.8 mtpt -105.43 146.63 29.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.792 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 65' ' ' ASP . 98.4 mt -78.8 -74.22 0.29 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.206 173.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 6.2 p-10 173.2 -44.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.543 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.7 p -136.86 -29.89 0.9 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.899 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.48 -44.76 97.58 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.766 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.42 -147.36 18.57 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.889 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -109.86 152.16 26.12 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.05 0.54 . . . . 0.0 109.684 -177.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -150.52 135.75 17.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.192 0.52 . . . . 0.0 111.305 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.653 HG12 HG12 ' A' ' 61' ' ' ILE . 66.5 mt -92.0 -24.02 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 122.198 0.999 . . . . 0.0 108.469 171.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.4 t -148.71 145.66 27.77 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.348 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -64.97 -21.4 66.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -169.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -86.48 -0.87 56.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.9 m -147.04 108.81 4.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.33 133.47 55.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.197 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -123.02 132.9 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.774 0.321 . . . . 0.0 110.622 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 m -79.45 3.4 18.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.6 m -150.68 132.63 15.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.57 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.7 mt -66.19 -25.32 66.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.682 -177.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -62.7 -46.8 86.45 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -66.67 -32.07 73.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.55 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.601 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -57.56 -65.95 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.302 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -62.54 -43.63 98.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.758 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.98 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.175 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -76.74 -43.56 36.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.729 0.3 . . . . 0.0 111.053 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 25.4 m-85 -70.73 -9.09 56.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.608 -177.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.646 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 70.6 m -67.45 -28.39 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.212 0.53 . . . . 0.0 110.013 173.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.49 -48.53 3.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.674 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 56.2 m170 -110.27 116.47 31.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.29 178.02 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.47 -38.01 65.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.814 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 61.02 -78.98 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.092 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.86 -40.59 5.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.739 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.627 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.17 149.36 50.59 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.956 0.408 . . . . 0.0 110.081 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 59.1 m -76.67 -17.93 58.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.537 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -133.04 134.02 43.83 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -68.95 151.27 46.75 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 74.2 mt -67.79 84.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.202 0.525 . . . . 0.0 109.848 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.8 m -73.82 -58.76 3.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.234 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -139.75 146.84 40.02 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.069 0.461 . . . . 0.0 110.095 -177.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.521 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.5 t -89.31 149.4 4.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.8 -179.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 18' ' ' LEU . 53.2 t -65.68 119.13 57.9 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.155 177.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.5 135.69 26.95 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.588 2.192 . . . . 0.0 112.465 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.0 p . . . . . 0 C--N 1.322 -0.61 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.762 176.917 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.79 85.54 7.28 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 175.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -69.24 108.36 3.62 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.787 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 30.42 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.788 1.635 . . . . 0.0 113.333 -173.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 5.1 p-90 -81.38 -34.78 31.47 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.997 -173.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.56 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 1.0 OUTLIER -86.45 88.45 7.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.083 0.468 . . . . 0.0 110.462 -174.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -75.98 -30.37 58.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.759 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.3 -157.72 14.76 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.737 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -82.49 57.52 3.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.484 0.659 . . . . 0.0 111.466 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.02 134.49 26.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -73.83 165.06 25.79 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.854 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' HE ' ' CD ' ' A' ' 16' ' ' GLU . 19.4 ttt180 -54.94 -49.57 71.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.743 -0.208 . . . . 0.0 111.238 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -61.5 -41.32 97.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.609 -175.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -61.57 -42.4 98.8 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.355 0.598 . . . . 0.0 110.019 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.2 t -67.83 -41.21 83.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.085 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.406 ' CD ' ' HE ' ' A' ' 12' ' ' ARG . 49.6 mt-10 -61.53 -42.19 98.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.503 0.192 . . . . 0.0 110.972 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -57.98 -35.37 71.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.334 . . . . 0.0 110.908 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -78.13 -40.94 36.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.804 HD21 HD22 ' A' ' 30' ' ' LEU . 97.2 mt -76.95 -39.21 51.44 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -174.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.01 38.16 0.27 Allowed 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.469 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 23.7 m-80 -89.51 118.75 69.34 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.23 -18.07 17.18 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.359 2.706 . . . . 0.0 113.461 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -86.58 -2.26 58.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.533 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.469 ' ND2' ' HB2' ' A' ' 21' ' ' ASN . 95.9 m-20 -84.89 131.89 47.69 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.813 0.339 . . . . 0.0 110.421 177.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -82.64 156.42 16.09 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.705 2.27 . . . . 0.0 111.919 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 33.8 ttp180 -61.64 123.32 17.57 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.096 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.51 -5.0 10.91 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.436 -175.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 87.0 m -66.06 114.38 5.17 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.908 0.416 . . . . 0.0 110.123 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 43.2 p90 -128.55 166.7 18.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.755 0.312 . . . . 0.0 111.625 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.804 HD22 HD21 ' A' ' 19' ' ' LEU . 1.7 pt? -169.11 152.03 4.94 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.3 p -110.54 119.28 59.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.443 0.64 . . . . 0.0 111.006 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 10.5 ptp85 -102.04 151.32 22.29 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.495 178.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -93.85 117.22 29.81 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -76.71 121.4 23.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 0.0 110.946 -174.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -91.98 -16.12 26.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.059 174.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 t -88.73 -13.88 38.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.627 0.727 . . . . 0.0 109.582 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.6 m -139.35 93.17 2.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.658 171.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -69.96 141.87 52.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.651 -173.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.54 64.96 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.872 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.35 144.2 33.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.027 0.442 . . . . 0.0 110.341 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.604 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.0 m-85 -113.52 172.78 6.76 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.2 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 39.9 t -140.01 112.16 7.64 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.786 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.55 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.4 tm? -85.33 102.34 13.3 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 173.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 t -99.51 124.67 44.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.653 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -118.22 138.15 49.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.125 0.488 . . . . 0.0 110.58 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.9 m -91.05 105.84 18.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.437 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.478 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 3.7 m-20 -88.8 169.11 11.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.189 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -143.68 123.92 13.78 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.448 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -128.13 135.51 49.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -80.94 51.84 1.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.773 0.797 . . . . 0.0 109.772 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.51 -26.29 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.282 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -114.11 -20.34 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.342 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.13 -158.32 34.5 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.9 mp -74.32 114.01 12.19 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.84 127.52 49.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.346 0.593 . . . . 0.0 110.57 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 98.6 t -86.06 121.37 37.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.056 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.567 ' NZ ' ' HB2' ' A' ' 57' ' ' LYS . 3.4 ttmp? -102.05 110.41 22.37 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.726 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -89.08 99.76 12.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.702 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.411 ' CD2' ' HG ' ' A' ' 94' ' ' LEU . 12.9 m-85 -91.11 142.93 27.22 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 13.0 mmmm -99.42 131.58 45.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.925 -172.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.604 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -98.5 98.82 7.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.706 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.464 HH11 ' HD2' ' A' ' 62' ' ' ARG . 54.6 mtt180 -83.21 150.82 25.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.926 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -109.79 128.27 55.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.288 0.566 . . . . 0.0 111.646 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.494 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 79.3 mt -90.37 136.53 33.0 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.73 -12.25 59.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.201 0.524 . . . . 0.0 110.851 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -135.43 42.15 2.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.38 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -159.05 -70.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.804 -178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 156.87 -123.65 1.33 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.276 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -119.91 144.49 47.4 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -175.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.429 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 15.3 p90 -156.94 136.61 12.34 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.531 . . . . 0.0 110.849 175.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 60' ' ' LYS . 58.8 mt -87.11 -30.21 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.094 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -140.74 157.21 45.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.447 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.4 m -74.69 42.53 0.17 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.252 0.548 . . . . 0.0 111.575 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -125.95 -71.9 0.68 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.546 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.408 HG21 ' CE2' ' A' ' 86' ' ' TYR . 0.2 OUTLIER -96.11 125.6 40.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.959 179.085 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -130.93 131.14 44.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.913 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.594 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 92.9 m-85 -130.9 146.54 52.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.705 -175.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.428 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 19.9 m -83.42 3.12 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 41.2 m -152.06 156.74 40.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.549 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.6 mt -66.38 -43.49 85.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.835 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -58.76 -47.34 85.04 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.841 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.477 ' HB3' ' HB3' ' A' ' 77' ' ' PHE . 20.4 tt0 -56.32 -35.1 67.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.115 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.441 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 7.9 tt -69.56 -60.49 2.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.886 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -60.84 -41.54 89.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -53.84 -45.79 71.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.748 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 75' ' ' THR . 66.6 t80 -71.57 -46.08 60.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.858 0.361 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.594 ' HE1' ' HE2' ' A' ' 77' ' ' PHE . 2.5 m-85 -66.55 -11.93 55.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.22 -177.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.2 t -72.34 -27.42 62.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 110.344 176.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -104.53 -48.64 3.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.351 0.596 . . . . 0.0 110.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.7 t-160 -113.54 108.23 16.89 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.93 87.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.505 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.3 t70 67.75 -67.03 0.19 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.758 174.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -110.06 -32.26 2.88 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.212 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.2 mp -69.46 155.79 39.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.063 0.458 . . . . 0.0 111.07 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 m -78.55 -19.43 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.462 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -142.43 135.04 28.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.235 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -74.37 144.85 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.006 0.432 . . . . 0.0 111.174 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 69.6 mt -56.83 109.76 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.63 -176.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.1 m -98.71 -60.09 1.61 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 -173.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.577 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.7 p-10 -134.63 147.22 50.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.749 -176.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.423 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.1 t -88.37 146.58 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -55.39 122.07 41.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 O-C-N 123.718 0.636 . . . . 0.0 111.307 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -78.02 136.14 14.51 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.29 1.994 . . . . 0.0 112.086 177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 t -110.61 171.26 7.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 10.8 t -140.42 33.09 1.87 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.249 0.547 . . . . 0.0 109.709 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.657 ' HA ' ' HE3' ' A' ' 106' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.486 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 121.787 0.803 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.9 53.39 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.394 -1.275 . . . . 0.0 107.788 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.91 140.29 58.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.823 -166.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -52.64 -39.45 61.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.506 -1.224 . . . . 0.0 113.423 -168.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -66.08 -33.35 75.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 79.2 t80 -83.47 99.93 10.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.776 0.322 . . . . 0.0 110.378 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.6 m-85 -83.68 -24.07 31.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.201 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.13 -166.14 13.35 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.86 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 44.6 pttt -86.69 78.81 9.05 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.632 0.73 . . . . 0.0 111.324 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 pt -97.79 149.81 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -76.53 171.01 15.33 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.83 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -58.18 -47.81 82.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.109 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.462 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 45.5 mtp180 -56.66 -41.6 77.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.166 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.88 -52.86 46.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.063 0.458 . . . . 0.0 110.531 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 6.9 m -62.14 -55.1 32.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.553 -174.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 56' ' ' VAL . 34.4 mt-10 -71.88 -22.51 61.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.094 -173.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.576 ' HG3' ' HE2' ' A' ' 106' ' ' LYS . 8.4 tpt180 -76.33 -23.23 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.059 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -88.85 -21.57 23.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.829 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.622 HD21 HD22 ' A' ' 30' ' ' LEU . 80.2 mt -93.88 -31.87 14.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.822 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.426 ' HA ' HD13 ' A' ' 20' ' ' LEU . 3.5 mm? -77.66 53.35 1.09 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.145 0.498 . . . . 0.0 111.298 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.523 ' HB2' ' OD1' ' A' ' 24' ' ' ASN . 87.3 m-20 -113.63 128.97 25.12 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 173.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.91 -12.2 21.3 Favored 'Trans proline' 0 N--CA 1.471 0.191 0 C-N-CA 122.843 2.362 . . . . 0.0 112.866 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -83.72 -33.63 25.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.796 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.523 ' OD1' ' HB2' ' A' ' 21' ' ' ASN . 4.3 m-20 -54.12 116.89 11.37 Favored Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.549 -178.075 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.96 151.44 24.1 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.487 2.124 . . . . 0.0 112.061 177.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -55.49 116.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.408 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.53 -2.89 9.49 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.804 -0.713 . . . . 0.0 111.958 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.503 ' HB ' ' HB2' ' A' ' 46' ' ' SER . 46.3 m -73.05 121.86 20.83 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 175.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -134.9 159.11 42.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.036 0.446 . . . . 0.0 111.873 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.622 HD22 HD21 ' A' ' 19' ' ' LEU . 2.3 pt? -155.59 137.35 14.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.97 170.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.4 p -99.8 114.48 38.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.717 0.77 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 ptt85 -115.11 160.17 19.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.575 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.663 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.9 tt0 -99.78 139.75 34.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.508 ' HB3' HG22 ' A' ' 36' ' ' THR . 45.6 m -100.11 115.77 30.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.292 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -64.32 -17.26 63.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.009 -174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.508 HG22 ' HB3' ' A' ' 34' ' ' SER . 10.6 t -61.47 -22.17 64.83 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.713 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.0 m -151.49 102.08 2.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.511 ' NZ ' ' HB2' ' A' ' 38' ' ' LYS . 4.4 ttmp? -55.61 113.36 1.42 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.095 -177.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.97 -2.2 48.01 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.612 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -100.01 112.96 25.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.793 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 75.5 m-85 -96.43 161.88 13.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.075 -177.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.53 117.7 19.12 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.83 176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -82.38 85.6 6.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.411 ' O ' HD23 ' A' ' 30' ' ' LEU . 19.2 m -74.46 111.9 10.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.907 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.8 p -107.86 136.86 41.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.006 0.431 . . . . 0.0 110.742 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.503 ' HB2' ' HB ' ' A' ' 28' ' ' THR . 15.4 m -81.04 107.55 13.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.875 176.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -102.86 147.87 26.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.849 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.559 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 88.1 t80 -133.46 113.7 12.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.404 0.621 . . . . 0.0 110.534 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -96.68 139.47 32.7 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.667 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -81.48 49.83 1.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.281 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -171.32 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.537 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -105.2 5.81 32.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.667 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.02 -146.62 38.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.138 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.559 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.1 mp -96.29 147.0 24.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 0.0 110.891 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -143.67 154.56 43.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.399 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.418 HG21 ' HG2' ' A' ' 16' ' ' GLU . 84.1 t -108.15 120.01 58.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 120.976 0.417 . . . . 0.0 111.078 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -102.14 114.42 28.54 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.688 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -89.71 86.04 6.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.052 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.408 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 49.9 m-85 -69.0 129.24 39.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.838 0.351 . . . . 0.0 110.805 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 38.9 mmtm -75.03 122.24 23.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.505 -172.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 59.2 mt -107.29 87.24 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -110.74 163.17 14.03 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.496 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 36.3 mtmm -99.29 150.17 22.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.34 0.59 . . . . 0.0 111.73 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.511 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 68.7 mt -95.56 177.11 5.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.79 -1.095 . . . . 0.0 109.993 172.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -51.23 -58.16 6.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.437 0.46 . . . . 0.0 110.897 175.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 p -142.21 14.43 2.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.045 0.45 . . . . 0.0 111.547 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -84.71 -32.96 20.33 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.348 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 110.19 -144.61 17.01 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.829 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -93.92 143.26 26.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.511 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 13.1 p90 -154.86 139.63 17.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.933 0.397 . . . . 0.0 110.74 177.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.65 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 62.1 mt -97.12 -26.27 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 122.071 0.939 . . . . 0.0 108.505 171.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.479 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.3 t -136.37 144.04 44.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.069 -1.423 . . . . 0.0 108.678 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.3 m -68.82 -15.74 63.59 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -170.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HD2' ' OD1' ' A' ' 92' ' ' ASP . 61.5 mtt85 -71.32 -58.74 3.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 0.0 110.874 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.42 HG21 ' CE1' ' A' ' 86' ' ' TYR . 25.1 m -102.54 124.08 47.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.28 -175.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -124.93 137.29 54.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.829 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -137.53 135.75 37.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.669 0.271 . . . . 0.0 110.784 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.0 m -88.38 14.18 10.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.152 0.501 . . . . 0.0 110.702 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 29.0 m -143.65 132.05 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.784 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.449 ' O ' HG22 ' A' ' 84' ' ' VAL . 88.6 mt -66.93 -25.29 66.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.06 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -48.11 79.09 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.95 -32.8 74.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.524 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -54.67 -64.8 0.72 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.534 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -66.64 -40.8 87.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.089 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.55 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.924 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.42 ' CE1' HG21 ' A' ' 75' ' ' THR . 60.9 t80 -93.04 -47.33 7.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.696 0.284 . . . . 0.0 111.04 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.65 ' HE2' ' HB ' ' A' ' 71' ' ' ILE . 2.8 m-85 -68.75 -9.0 48.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.035 -175.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.649 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 5.8 p -72.69 -33.37 66.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.374 0.607 . . . . 0.0 110.33 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -100.86 -39.83 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.678 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 34.3 m170 -115.47 111.99 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.93 -33.81 64.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.993 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.492 ' OD1' ' HD2' ' A' ' 74' ' ' ARG . 9.8 t70 62.9 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.566 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -101.23 -32.0 5.4 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 121.237 -0.506 . . . . 0.0 112.088 -178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.615 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -68.6 152.51 45.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 74.1 m -90.75 13.13 17.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 109.851 174.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -140.18 134.39 31.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.653 -175.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -97.78 120.22 37.78 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 63.9 mt -52.25 106.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 111.201 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.2 m -98.8 -58.47 1.94 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.269 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 p30 -135.45 151.95 50.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -90.23 146.41 6.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 120.773 0.32 . . . . 0.0 110.191 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 49.8 t -52.56 133.93 44.84 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.821 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.9 Cg_exo -65.9 135.73 42.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.796 2.331 . . . . 0.0 111.011 173.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -13.91 61.16 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -177.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 62.7 m -136.26 135.2 38.8 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.23 0.538 . . . . 0.0 111.618 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.576 ' HE2' ' HG3' ' A' ' 17' ' ' ARG . 22.6 pttp . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.656 175.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 121.28 0.562 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.12 76.28 1.32 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.196 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -82.09 -172.53 4.0 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.327 -172.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.444 ' O ' HG11 ' A' ' 101' ' ' VAL . 15.6 mm-40 -50.11 -51.91 39.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.604 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.535 ' CD1' HG21 ' A' ' 84' ' ' VAL . 1.2 p-90 -84.61 -23.71 29.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.163 -173.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.432 ' HA ' HG13 ' A' ' 31' ' ' VAL . 23.0 t80 -85.18 106.73 16.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.552 -173.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.6 -21.75 26.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.878 0.37 . . . . 0.0 111.098 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.08 -163.57 12.35 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.48 -0.867 . . . . 0.0 113.489 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -83.84 56.63 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.817 0.447 . . . . 0.0 111.219 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.538 ' O ' ' HD2' ' A' ' 32' ' ' ARG . 39.5 pt -90.41 139.21 17.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.084 0.468 . . . . 0.0 110.092 177.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -78.76 177.56 8.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.755 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -55.26 -46.82 76.09 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -177.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -56.12 -48.5 76.08 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.787 -177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -59.9 -36.12 76.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.241 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -64.38 -52.83 56.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.82 0.343 . . . . 0.0 110.449 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -70.11 -29.28 66.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.648 -179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -57.75 -40.01 78.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.019 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.2 mt -88.04 -31.15 19.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.873 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.55 HD21 HD22 ' A' ' 30' ' ' LEU . 59.9 mt -82.39 -30.65 30.08 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -172.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' HA ' HD13 ' A' ' 20' ' ' LEU . 1.9 mm? -77.52 26.65 0.17 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.241 0.473 . . . . 0.0 112.216 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -99.17 120.03 59.21 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.21 -3.63 4.25 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 C-N-CA 123.42 2.747 . . . . 0.0 114.034 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -77.57 -12.68 59.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.467 . . . . 0.0 110.463 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -83.83 124.65 74.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.998 -178.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.89 151.01 27.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.56 2.173 . . . . 0.0 112.232 175.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -56.28 113.46 1.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.687 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.55 10.04 8.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.192 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 88.2 m -83.35 114.89 21.73 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.301 0.24 . . . . 0.0 110.454 176.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -122.5 162.51 21.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 111.259 -175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.55 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -159.18 128.48 5.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.541 172.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.468 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 p -94.97 121.06 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.759 0.79 . . . . 0.0 110.659 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 38.3 ptt85 -108.69 160.1 16.22 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.794 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -92.71 135.96 33.65 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -97.38 101.06 12.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.35 -34.8 58.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.942 -171.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.8 p -86.49 19.3 2.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -173.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.505 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 26.5 m -152.2 124.29 8.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.963 0.411 . . . . 0.0 110.087 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -70.32 104.75 2.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.611 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.93 5.78 65.89 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.083 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.505 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -95.07 113.86 25.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.276 0.56 . . . . 0.0 110.312 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 71.9 m-85 -104.76 169.23 8.57 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.227 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.3 m -133.51 108.88 8.89 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.961 0.41 . . . . 0.0 110.542 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -83.07 84.77 7.34 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.5 t -81.27 127.82 33.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.383 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 13.9 p -125.61 138.61 53.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.0 t -78.25 119.45 21.64 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.725 0.774 . . . . 0.0 110.293 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -95.78 153.48 17.72 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.591 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -135.89 107.74 7.08 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.957 -175.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -90.77 139.81 30.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 173.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -84.13 -2.04 56.07 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -172.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -120.21 -51.22 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -84.62 -25.81 28.3 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.588 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.22 -166.69 12.17 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.081 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.623 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.5 pt? -79.3 146.25 33.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.104 0.478 . . . . 0.0 111.496 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -137.12 178.18 7.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.148 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 99.3 t -121.97 128.73 75.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.024 0.44 . . . . 0.0 110.306 177.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -111.26 95.53 5.58 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.547 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -76.94 91.58 3.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.458 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.489 ' HB3' HG23 ' A' ' 71' ' ' ILE . 70.4 m-85 -78.18 137.06 37.96 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -104.82 133.68 49.24 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.145 0.498 . . . . 0.0 110.982 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 71' ' ' ILE . 66.6 mt -104.23 96.38 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.103 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.7 ttp180 -88.22 134.69 33.72 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.969 0.414 . . . . 0.0 110.421 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -82.42 127.73 33.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.773 177.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.7 mt -99.64 115.33 29.18 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.237 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.01 -25.74 67.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.326 0.584 . . . . 0.0 110.089 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -99.29 11.43 39.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.239 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.51 -102.43 0.18 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.955 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -161.78 -136.38 1.99 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.25 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -114.39 138.61 50.33 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.413 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 13.7 p90 -147.91 143.33 27.29 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.102 0.477 . . . . 0.0 110.959 177.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 61' ' ' ILE . 57.9 mt -95.75 -36.76 6.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.159 174.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.01 148.18 52.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.365 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.454 ' O ' ' HD2' ' A' ' 74' ' ' ARG . 14.4 p -78.91 47.04 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -172.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 73' ' ' SER . 30.6 mmm180 -125.44 -62.72 1.19 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.4 m -108.93 133.4 53.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.63 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.413 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 72.6 mt-30 -129.17 135.22 48.56 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.538 0.209 . . . . 0.0 110.501 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -121.11 155.38 34.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.874 0.369 . . . . 0.0 110.867 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 p -93.41 -7.72 43.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 31.7 p -132.51 139.29 47.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.995 0.426 . . . . 0.0 110.146 177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.646 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.4 mt -68.47 -26.56 65.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.915 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -62.8 -47.3 84.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -71.23 -29.91 65.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.334 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.604 HD11 HD11 ' A' ' 71' ' ' ILE . 3.1 tm? -56.88 -62.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.045 176.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.8 m -64.35 -44.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.05 -46.28 71.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.74 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -73.78 -39.88 63.83 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.258 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 6.6 m-85 -74.0 -3.73 31.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.112 0.482 . . . . 0.0 111.536 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -82.26 -27.06 32.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 170.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.1 mttm -96.24 -49.91 5.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.807 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.618 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 35.1 m170 -125.53 119.29 27.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.2 174.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -70.45 -17.59 62.99 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.6 t70 66.55 -72.15 0.09 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.846 0.716 . . . . 0.0 111.193 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -116.31 -33.68 1.44 Allowed Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.623 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.4 mp -61.69 169.78 2.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.256 0.551 . . . . 0.0 111.057 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 41.8 t -116.35 -22.75 8.66 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.135 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 53.3 m80 -87.42 -32.02 19.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.202 -170.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 96' ' ' HIS . 49.5 mtp180 66.82 124.82 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.556 0.535 . . . . 0.0 110.018 -168.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 82.5 mt -61.03 104.45 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.607 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.6 m -96.02 -66.02 0.93 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.304 -173.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.9 p30 -133.02 150.13 52.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.51 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.7 t -89.91 145.72 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.1 t -46.33 130.38 7.77 Favored Pre-proline 0 C--O 1.234 0.256 0 O-C-N 123.99 0.807 . . . . 0.0 112.308 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.45 151.5 82.94 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.043 2.495 . . . . 0.0 111.916 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.9 p -88.2 137.84 31.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.573 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.9 p -91.65 16.11 11.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.113 0.482 . . . . 0.0 110.766 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 117.941 -1.028 . . . . 0.0 108.889 -177.821 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 N--CA 1.482 1.171 0 CA-C-O 121.403 0.62 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 176.82 50.88 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.389 -1.278 . . . . 0.0 108.144 -173.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.28 153.56 30.35 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.599 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -45.01 -48.44 11.57 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.49 ' HE3' HG11 ' A' ' 31' ' ' VAL . 7.7 p-90 -81.84 -43.03 18.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.651 0.262 . . . . 0.0 111.447 -178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 1.9 t80 -85.68 87.41 7.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.359 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.48 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 7.7 m-85 -67.04 -41.15 87.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.822 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.32 -165.61 18.41 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.752 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 pttm -84.29 73.65 10.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.506 0.669 . . . . 0.0 111.587 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.8 pt -94.61 144.99 8.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.986 175.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -84.23 177.53 8.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.244 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.468 ' HB3' ' OE2' ' A' ' 16' ' ' GLU . 25.1 mtp180 -56.08 -50.15 71.8 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 13' ' ' ARG . 52.9 mtp180 -52.86 -37.51 60.43 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.365 -178.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -79.45 -47.57 15.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.1 m -61.38 -49.24 77.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.984 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.468 ' OE2' ' HB3' ' A' ' 12' ' ' ARG . 42.1 mt-10 -68.27 -30.02 68.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.978 -177.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -59.89 -52.01 67.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.039 0.447 . . . . 0.0 110.858 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.522 HD22 ' OG1' ' A' ' 104' ' ' THR . 79.0 mt -70.12 -33.8 72.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.512 -174.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.771 HD21 HD22 ' A' ' 30' ' ' LEU . 55.1 mt -79.76 -32.9 41.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mp -81.27 8.78 8.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.79 0.328 . . . . 0.0 111.327 177.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' OD1' ' HG2' ' A' ' 23' ' ' GLU . 13.8 t-20 -67.52 126.68 92.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 175.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.54 23.66 0.17 Allowed 'Trans proline' 0 N--CA 1.478 0.597 0 C-N-CA 123.493 2.795 . . . . 0.0 115.514 -167.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.521 ' HG2' ' OD1' ' A' ' 21' ' ' ASN . 11.3 pt-20 -122.34 10.35 9.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.312 0.577 . . . . 0.0 110.063 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -96.83 122.12 57.62 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.274 -177.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -86.72 169.58 7.89 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.898 2.399 . . . . 0.0 111.758 173.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -61.89 112.2 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.591 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.69 2.8 6.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.399 -177.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 35.1 m -80.42 118.51 22.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CG ' HD22 ' A' ' 98' ' ' LEU . 28.7 p90 -129.78 165.83 21.14 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -173.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.771 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -164.64 145.84 8.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.3 171.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.49 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -108.15 124.45 64.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.328 0.585 . . . . 0.0 110.961 178.704 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.571 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 5.2 ptp180 -102.25 158.3 16.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.224 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -91.29 101.38 14.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 40' ' ' ALA . 34.5 t -73.93 111.78 9.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.111 0.481 . . . . 0.0 110.827 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.19 59.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 175.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 m -64.44 -36.33 83.83 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.813 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.9 m -147.6 109.46 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.325 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.59 132.84 53.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 92.01 1.74 69.76 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.827 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.543 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . -125.27 116.26 21.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.018 0.437 . . . . 0.0 109.864 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 90.4 m-85 -97.05 176.49 5.93 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.571 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 41.2 t -135.45 112.78 10.57 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.761 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.1 tm? -87.05 88.31 7.67 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 15.4 m -82.35 116.11 21.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.968 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 p -110.51 130.89 63.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.082 0.468 . . . . 0.0 110.038 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.497 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 41.4 t -78.24 122.58 25.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.341 177.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -116.87 123.68 47.63 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.943 -174.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.507 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 51.9 t80 -101.84 72.82 1.37 Allowed 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.54 ' HB2' ' HG2' ' A' ' 52' ' ' LYS . 15.5 m-20 -61.1 124.45 20.58 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.633 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -75.26 53.1 0.63 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.567 0.699 . . . . 0.0 110.834 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -162.22 -51.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.742 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.54 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 10.0 ptpp? -99.28 -23.58 15.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.173 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 97.89 -158.72 20.78 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.366 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 35.4 mt -64.55 120.67 12.78 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.403 0.621 . . . . 0.0 111.343 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.442 ' ND2' ' HD2' ' A' ' 52' ' ' LYS . 8.1 p30 -143.1 146.35 33.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.453 176.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.3 t -89.14 119.71 36.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HZ2' ' HB2' ' A' ' 57' ' ' LYS . 3.5 ttmp? -95.99 100.81 12.44 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -80.07 89.84 5.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.303 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -78.5 142.85 37.12 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -115.01 117.38 30.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.178 0.514 . . . . 0.0 110.76 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.683 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 63.5 mt -87.86 92.74 3.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.792 -178.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -100.2 144.01 29.73 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.911 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.67 157.77 19.0 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.791 -0.363 . . . . 0.0 110.056 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.415 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 7.7 mt -70.1 -91.69 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.956 176.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -134.16 -34.37 0.98 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.6 t -149.07 -31.13 0.24 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.068 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.48 68.57 0.36 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.51 -1.329 . . . . 0.0 113.519 -172.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -178.28 94.6 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.758 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -83.05 125.41 31.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.437 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 15.8 p90 -126.06 132.72 51.89 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.498 0.666 . . . . 0.0 111.768 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.63 HG21 HD11 ' A' ' 94' ' ' LEU . 65.4 mt -93.35 -39.69 11.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 168.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -121.16 179.79 4.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.891 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.0 t -73.18 -43.74 60.94 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -69.54 -56.71 6.58 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -170.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.451 ' HB ' ' CE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.68 120.59 32.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -169.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.437 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 2.2 mp0 -111.99 131.8 55.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.788 170.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.462 ' CE2' ' HE1' ' A' ' 87' ' ' TYR . 98.9 m-85 -123.28 131.34 53.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.636 0.255 . . . . 0.0 110.465 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.29 5.23 27.54 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.86 0.362 . . . . 0.0 111.783 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.1 m -147.7 137.54 22.74 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.961 0.41 . . . . 0.0 110.404 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.592 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.8 mt -72.75 -30.13 63.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.427 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -48.5 81.55 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -62.79 -35.72 80.79 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.565 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 HD11 ' A' ' 71' ' ' ILE . 2.8 tm? -58.34 -60.94 2.99 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.825 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -65.17 -44.13 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.48 -39.6 70.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.876 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -73.76 -48.52 31.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.592 0.235 . . . . 0.0 111.018 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 2.4 m-30 -69.99 -10.79 59.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.356 -177.025 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.513 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 10.7 t -70.28 -19.57 63.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.247 0.546 . . . . 0.0 110.132 176.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -116.15 -52.41 2.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.852 177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.517 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.1 t-160 -116.8 103.48 10.37 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.485 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -68.81 -27.34 65.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 -177.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.5 t70 70.11 -73.74 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.5 174.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.46 -49.57 2.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.794 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.74 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.3 mp -60.85 144.57 52.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.069 0.461 . . . . 0.0 110.643 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.9 t -74.6 -39.13 62.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -89.56 121.59 31.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.142 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.653 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -81.61 146.65 29.98 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.196 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.588 HD22 ' CG ' ' A' ' 29' ' ' PHE . 73.9 mt -69.04 85.68 0.35 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.218 0.532 . . . . 0.0 110.416 -177.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.7 m -78.17 -58.7 3.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.335 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.453 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.7 p-10 -132.94 143.74 49.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.949 -177.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.488 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -82.7 152.27 4.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.78 140.15 81.44 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.31 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.12 176.47 3.84 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.67 2.247 . . . . 0.0 111.167 172.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.522 ' OG1' HD22 ' A' ' 18' ' ' LEU . 24.0 p 57.39 -175.81 0.07 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.463 0.705 . . . . 0.0 110.797 -173.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.436 ' HA ' ' CE2' ' A' ' 7' ' ' PHE . 23.0 p -154.97 -10.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 0.0 111.159 175.061 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.421 ' H ' ' H ' ' A' ' 105' ' ' SER . 24.7 ttpp . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.216 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 120.943 0.402 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.02 119.99 40.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.436 173.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 52.8 mm-40 -79.09 178.41 8.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.065 -176.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -61.55 -52.46 64.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.002 0.429 . . . . 0.0 110.066 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 14.9 p-90 -79.79 -41.06 27.27 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.038 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.576 ' HE1' ' CE2' ' A' ' 41' ' ' TYR . 80.0 t80 -85.66 95.57 9.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.929 -177.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.583 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 30.6 m-85 -79.92 -20.96 44.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.209 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.76 -164.34 21.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.974 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 7.3 pttm -81.72 74.95 8.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.117 0.484 . . . . 0.0 111.846 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.678 HG13 ' HD2' ' A' ' 32' ' ' ARG . 39.4 pt -97.41 145.21 9.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -75.08 165.68 24.85 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.447 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 57.9 mtm180 -56.84 -51.0 70.72 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.104 0.252 . . . . 0.0 110.468 -176.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -49.48 -48.85 47.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.661 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.55 -47.58 84.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.299 0.571 . . . . 0.0 110.335 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 45.2 t -64.29 -47.3 80.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.326 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.496 ' HA ' HG21 ' A' ' 56' ' ' VAL . 48.3 mt-10 -68.96 -34.75 75.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.589 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.4 -25.05 68.11 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.489 . . . . 0.0 110.336 177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -88.07 -39.37 14.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.519 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.539 HD21 HD22 ' A' ' 30' ' ' LEU . 88.4 mt -77.02 -25.46 52.64 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.4 mm? -77.54 4.4 11.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.6 t30 -83.14 109.77 19.41 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.1 Cg_exo -65.67 14.39 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.883 3.055 . . . . 0.0 114.409 -170.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -83.54 -3.67 57.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.785 0.326 . . . . 0.0 110.51 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -110.96 143.22 27.84 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.541 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -82.0 164.41 17.7 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 123.09 2.527 . . . . 0.0 112.458 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.498 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 54.4 ttp180 -68.82 106.25 2.62 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.868 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.93 2.92 2.08 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 -174.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 68.8 m -76.64 132.46 39.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.198 -0.501 . . . . 0.0 109.757 175.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.564 ' CG ' HD22 ' A' ' 98' ' ' LEU . 31.0 p90 -137.04 166.33 23.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.158 0.504 . . . . 0.0 112.002 -175.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.583 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.3 pt? -162.51 141.9 9.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.391 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.75 118.16 55.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.502 0.668 . . . . 0.0 110.666 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.678 ' HD2' HG13 ' A' ' 10' ' ' ILE . 11.3 mtm180 -104.58 162.07 13.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.179 -177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.653 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.2 tt0 -97.63 129.91 44.69 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 174.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.2 m -67.85 140.98 56.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.519 0.676 . . . . 0.0 111.317 -176.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.74 -38.5 91.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.83 -177.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.6 p -103.21 -66.65 0.93 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.563 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.2 m -70.74 99.33 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.152 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.25 133.35 37.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.945 0.402 . . . . 0.0 109.923 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.69 -11.16 61.06 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -173.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.553 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -104.15 126.46 51.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.576 ' CE2' ' HE1' ' A' ' 6' ' ' TYR . 60.3 m-85 -117.34 143.33 46.07 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.175 0.512 . . . . 0.0 111.09 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.7 m -99.16 94.13 6.34 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 -176.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.723 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.2 tm? -81.24 98.38 8.07 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 172.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.7 m -97.86 132.83 43.11 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.729 -175.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.535 HG21 HD23 ' A' ' 94' ' ' LEU . 3.0 t -112.61 139.44 37.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.927 -177.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.402 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 78.6 p -77.41 96.73 4.74 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.708 0.766 . . . . 0.0 109.388 174.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.81 138.81 31.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.596 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.498 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 79.7 t80 -122.59 122.45 38.88 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.302 0.572 . . . . 0.0 110.972 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -106.59 152.53 23.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.146 173.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -84.13 -1.92 55.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.746 0.307 . . . . 0.0 111.289 -173.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -123.2 -44.64 2.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.883 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -82.06 -25.52 34.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.164 -177.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.76 -141.58 17.25 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.815 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 78.5 mt -82.86 137.5 34.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.249 0.547 . . . . 0.0 111.322 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -146.4 154.83 42.08 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.496 HG21 ' HA ' ' A' ' 16' ' ' GLU . 58.3 t -97.83 115.56 38.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.966 -178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -89.98 105.72 18.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.679 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -86.7 107.26 18.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.885 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.619 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 4.0 m-85 -95.85 135.0 38.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.959 0.409 . . . . 0.0 110.713 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -95.34 102.7 14.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 71' ' ' ILE . 54.8 mt -82.24 87.01 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.1 mtm180 -86.01 156.07 20.6 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -107.94 155.49 20.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.297 0.57 . . . . 0.0 111.328 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 95.7 mt -108.18 141.21 40.27 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.912 -1.04 . . . . 0.0 108.868 172.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -64.3 -25.42 68.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.6 t -135.44 45.03 2.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.099 0.476 . . . . 0.0 110.13 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.09 -77.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.44 -157.03 28.62 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.005 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.459 ' HB3' ' CG2' ' A' ' 61' ' ' ILE . 73.5 m-85 -99.36 136.28 39.53 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -179.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.505 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 52.3 p90 -140.04 137.65 34.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.243 0.544 . . . . 0.0 111.078 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 61' ' ' ILE . 45.2 mt -82.63 -26.73 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.898 0.856 . . . . 0.0 109.385 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' HB2' ' A' ' 74' ' ' ARG . 8.8 t -155.59 167.87 28.98 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.269 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.9 t -80.71 54.39 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.686 0.755 . . . . 0.0 109.738 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.602 ' HB2' HG23 ' A' ' 72' ' ' THR . 13.7 mmm180 -126.34 -78.64 0.59 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.539 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.0 m -105.04 131.72 52.19 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.505 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 73.9 mt-30 -126.43 125.62 42.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.759 0.314 . . . . 0.0 110.8 -176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -121.54 141.11 51.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.312 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -78.49 -0.92 31.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -174.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.6 m -153.48 161.38 42.31 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.414 ' O ' HG22 ' A' ' 84' ' ' VAL . 96.0 mt -81.21 -19.8 42.46 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -168.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.6 tp60 -68.2 -45.19 74.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -59.48 -32.86 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.898 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.474 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -59.64 -63.92 1.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.413 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.428 HG22 ' H ' ' A' ' 84' ' ' VAL . 0.1 OUTLIER -64.16 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -176.338 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.72 -32.87 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -90.42 -44.58 9.55 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.223 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.584 ' HD2' HD13 ' A' ' 94' ' ' LEU . 16.1 m-85 -74.6 -7.16 52.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 23.0 p -79.26 -21.39 46.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.156 0.503 . . . . 0.0 109.707 172.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -100.96 -47.82 4.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.057 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 93.3 m-70 -127.14 117.79 23.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.446 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -67.55 -29.77 69.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.076 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.5 t70 64.75 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.561 0.538 . . . . 0.0 112.442 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -93.53 -34.84 6.44 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.646 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.0 mp -72.14 159.08 34.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.33 -0.435 . . . . 0.0 110.204 174.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 18.3 t -103.54 2.4 33.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.763 0.792 . . . . 0.0 108.877 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -123.91 112.05 16.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.311 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.9 ptt180 -68.49 136.48 53.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.4 mt -60.33 97.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.376 0.423 . . . . 0.0 109.977 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 11.2 m -89.68 -46.9 8.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.076 0.465 . . . . 0.0 111.291 -172.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.5 p-10 -146.92 154.17 40.98 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.703 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.9 t -91.62 155.37 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -177.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 43.2 t -54.3 120.22 24.61 Favored Pre-proline 0 C--O 1.236 0.347 0 O-C-N 123.535 0.522 . . . . 0.0 111.865 -177.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.9 Cg_exo -69.58 139.35 40.63 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 111.383 175.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 p -106.47 131.44 53.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.1 t -73.58 102.22 3.82 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? . . . . . 0 C--O 1.248 0.997 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.712 -175.846 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.35 0.595 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.15 118.4 30.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.104 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -70.2 154.23 42.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.449 -177.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -76.65 -42.94 40.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.525 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -75.26 -37.0 61.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.301 -172.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -86.35 105.23 16.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 0.0 110.68 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.493 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 22.7 m-85 -90.8 -11.41 39.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.32 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.74 -158.21 24.98 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.674 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 66.03 4.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.84 141.92 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.6 p -84.99 170.35 13.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.913 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -54.43 -51.06 66.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.702 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 35.7 ttp180 -53.37 -40.23 64.82 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.511 0.507 . . . . 0.0 110.793 -177.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -68.19 -53.61 23.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.498 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.2 m -61.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.235 -177.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.19 -24.04 63.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.208 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 38.6 ttp-105 -62.8 -37.97 88.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.789 176.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.31 -33.71 32.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.17 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.677 HD21 HD22 ' A' ' 30' ' ' LEU . 92.2 mt -78.87 -31.55 45.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -172.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.61 10.64 3.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 5.4 m-20 -86.55 125.36 67.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-O 120.716 0.294 . . . . 0.0 110.329 175.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 14.3 Cg_exo -69.88 8.48 0.79 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.3 2.667 . . . . 0.0 112.57 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -82.43 -15.6 52.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.779 177.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -92.34 133.5 29.82 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.945 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.61 144.28 35.44 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.858 2.372 . . . . 0.0 111.631 175.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.589 ' HD3' ' O ' ' A' ' 48' ' ' PHE . 43.6 ttp180 -52.68 114.35 1.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.486 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.58 7.07 6.39 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.432 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 51.7 m -72.19 116.43 12.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.0 110.872 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.539 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.8 p90 -126.61 165.99 18.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.926 0.393 . . . . 0.0 111.203 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.677 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -164.0 142.49 7.48 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 171.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.4 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -106.68 124.24 62.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.674 0.75 . . . . 0.0 110.775 -179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 15.8 ptt180 -115.14 147.69 39.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.249 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -78.7 121.58 24.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.131 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.8 m -96.62 119.72 35.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.271 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.55 -22.71 40.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.073 -174.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.0 m -69.37 -21.88 63.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.009 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 39' ' ' GLY . 97.4 m -149.92 120.3 7.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.451 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -81.16 15.22 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.206 0.527 . . . . 0.0 111.34 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.632 ' H ' HG22 ' A' ' 37' ' ' THR . . . -134.2 22.48 3.77 Favored Glycine 0 C--N 1.307 -1.048 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.065 -176.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.35 108.75 2.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.791 0.329 . . . . 0.0 111.339 -178.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.688 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 35.3 m-85 -85.93 152.77 22.69 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 170.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.463 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -109.79 105.81 15.17 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.674 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -90.33 91.82 8.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 173.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -87.48 107.83 18.75 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.973 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.1 p -108.15 130.69 60.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.993 0.425 . . . . 0.0 110.475 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 42.7 t -87.36 124.2 33.13 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.628 0.727 . . . . 0.0 109.918 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.424 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 12.3 t70 -120.42 135.41 55.05 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.093 -176.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.589 ' O ' ' HD3' ' A' ' 26' ' ' ARG . 75.0 t80 -116.74 149.07 40.48 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.801 -178.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.519 ' HB3' ' HB3' ' A' ' 52' ' ' LYS . 16.7 t70 -140.93 146.37 37.31 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -73.4 -13.87 61.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.3 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.52 -37.67 2.75 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 6.9 ttpm? -83.87 -25.23 30.42 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.862 0.363 . . . . 0.0 111.358 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.68 -164.98 34.75 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.929 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.9 mt -76.45 139.23 40.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.56 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -150.63 143.1 24.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.036 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.23 119.79 57.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.073 0.464 . . . . 0.0 110.4 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 44.0 mttm -94.19 99.46 11.71 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.67 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -80.99 86.81 6.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.319 -0.401 . . . . 0.0 109.93 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 45.5 m-85 -75.91 141.99 42.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.075 0.464 . . . . 0.0 110.885 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -98.69 109.36 22.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.778 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 71' ' ' ILE . 54.3 mt -84.02 92.09 2.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.498 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -76.57 146.68 38.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.73 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.845 ' HE2' ' HA ' ' A' ' 65' ' ' ASP . 21.2 ptmt -110.89 148.54 32.23 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.207 0.527 . . . . 0.0 110.602 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.1 mt -90.13 26.98 1.73 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.666 173.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.845 ' HA ' ' HE2' ' A' ' 63' ' ' LYS . 13.4 t70 63.91 -66.26 0.11 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.879 -174.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 54.9 m -125.04 -11.71 7.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -177.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -79.45 -18.13 74.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.834 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.5 -170.43 23.03 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.154 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -120.45 138.41 53.81 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.653 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 38.5 p90 -143.81 130.16 19.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.36 0.6 . . . . 0.0 111.569 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 61' ' ' ILE . 69.5 mt -77.97 -42.7 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.138 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.5 t -115.45 151.33 34.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.13 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.2 p -76.06 21.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.951 0.405 . . . . 0.0 112.045 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -104.69 -52.66 2.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.244 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.3 m -125.19 112.03 15.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.047 0.451 . . . . 0.0 111.714 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.653 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -109.85 150.87 27.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.354 176.275 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.469 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 88.0 m-85 -128.45 149.69 50.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.2 m -76.96 -12.05 59.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.212 0.529 . . . . 0.0 110.993 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 16.7 m -138.06 136.6 36.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.998 -177.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.558 ' O ' HG22 ' A' ' 84' ' ' VAL . 91.8 mt -69.83 -22.32 63.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.981 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -48.55 76.29 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.86 -34.76 78.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.413 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -55.2 -62.38 1.71 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.504 178.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -63.32 -41.63 93.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.856 -176.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.3 71.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.22 -43.04 65.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.207 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 5.8 m-85 -75.83 -2.11 28.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.138 0.494 . . . . 0.0 111.468 -176.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.0 t -78.96 -21.17 47.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.352 0.596 . . . . 0.0 109.392 172.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HE3' ' HB3' ' A' ' 89' ' ' LYS . 22.8 mtpp -109.13 -49.5 3.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.979 177.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.608 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 76.0 m-70 -111.65 101.11 9.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.5 177.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -69.97 -33.97 72.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 t70 62.94 -82.79 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.249 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.17 -42.38 8.75 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.707 -0.557 . . . . 0.0 111.707 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.611 ' HB2' ' HB1' ' A' ' 91' ' ' ALA . 5.3 mp -63.04 143.17 58.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.244 0.545 . . . . 0.0 110.939 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.0 -17.81 60.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -140.32 132.71 28.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.314 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.592 ' H ' ' HD2' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -69.19 142.54 54.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.929 -179.658 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -60.87 109.77 1.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.169 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -98.97 -51.49 3.84 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -171.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 28' ' ' THR . 2.6 p-10 -145.0 148.95 34.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.0 t -89.24 143.81 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 51.4 t -55.81 126.54 65.54 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.058 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 20.6 Cg_exo -65.95 129.69 22.61 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.713 2.275 . . . . 0.0 111.162 174.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -102.23 -177.74 3.49 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.978 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.5 m 63.37 69.41 0.57 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.452 0.644 . . . . 0.0 110.71 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 53.4 tptt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.395 -178.323 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.902 0.382 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.38 85.3 1.78 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.251 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.6 mm-40 -78.96 101.13 7.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.487 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 28.19 -78.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 125.461 1.726 . . . . 0.0 114.342 -170.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.453 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 10.7 p-90 -76.77 -35.56 57.63 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.546 -174.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.456 ' HA ' HG13 ' A' ' 31' ' ' VAL . 88.3 t80 -94.93 99.99 11.92 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.202 -176.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.636 ' HD2' ' HB2' ' A' ' 30' ' ' LEU . 42.2 m-85 -88.81 9.04 26.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.879 0.371 . . . . 0.0 111.923 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.01 -144.71 22.03 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.991 174.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -100.14 68.86 1.47 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.392 0.615 . . . . 0.0 111.636 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.0 pt -90.77 137.38 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.473 172.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -73.35 165.97 24.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.592 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -60.46 -37.8 82.15 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.581 -173.119 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 28.2 tpt180 -66.02 -40.32 90.98 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.528 -178.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.57 -45.84 88.63 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.987 0.422 . . . . 0.0 110.598 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -61.94 -48.88 78.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.814 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -67.93 -33.52 74.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.891 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 tpt85 -58.13 -29.14 65.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.018 0.437 . . . . 0.0 110.505 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.95 -38.99 14.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.953 177.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.612 HD21 HD22 ' A' ' 30' ' ' LEU . 76.8 mt -74.88 -20.05 59.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -174.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.23 14.46 3.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.604 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 27.0 t30 -62.58 115.07 14.29 Favored Pre-proline 0 C--N 1.33 -0.253 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 170.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.504 ' HA ' HD11 ' A' ' 54' ' ' LEU . 29.0 Cg_exo -62.66 -0.42 1.95 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.402 2.734 . . . . 0.0 114.281 -171.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -112.26 1.63 16.22 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.318 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.604 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 92.2 m-20 -66.74 128.7 93.98 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 10.0 Cg_exo -70.61 142.44 44.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.845 2.363 . . . . 0.0 111.285 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.437 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 47.8 ttp180 -64.81 110.95 2.58 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.88 2.61 6.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.688 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 58.7 m -75.28 118.12 17.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.548 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.4 p90 -124.57 161.31 26.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.123 0.487 . . . . 0.0 112.117 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.636 ' HB2' ' HD2' ' A' ' 7' ' ' PHE . 1.8 pt? -161.44 138.88 8.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 0.0 108.979 170.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.495 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.6 p -106.51 125.64 62.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.679 0.752 . . . . 0.0 111.09 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 24.8 ptt85 -116.15 150.01 38.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.317 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -88.31 127.22 35.47 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.1 m -79.9 110.26 15.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.13 0.49 . . . . 0.0 110.985 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -25.06 61.32 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.6 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.86 -3.77 58.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.689 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.5 m -155.0 94.75 1.67 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.576 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -84.84 38.75 0.72 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.716 0.769 . . . . 0.0 110.993 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.01 12.91 4.73 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.186 -1.165 . . . . 0.0 110.186 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.567 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -163.0 142.13 8.66 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.936 -0.632 . . . . 0.0 110.382 -175.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 50.8 m-85 -109.15 179.3 4.2 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 173.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -134.42 109.08 8.52 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.228 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -90.25 87.51 6.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.4 m -80.69 119.96 23.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.625 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.67 139.79 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.035 0.445 . . . . 0.0 110.265 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.7 t -83.49 119.64 24.93 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 121.722 0.772 . . . . 0.0 110.384 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.437 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 12.7 t70 -106.47 145.64 31.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.282 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.539 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 77.9 t80 -123.32 124.75 43.67 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.644 -173.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -111.89 140.74 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.221 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -82.62 -11.08 58.65 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -172.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -113.51 -35.82 5.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.739 0.304 . . . . 0.0 111.136 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -87.5 -51.64 5.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.318 0.58 . . . . 0.0 110.32 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 131.83 -150.97 19.66 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -174.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.539 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.2 mp -90.54 139.31 30.81 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -125.73 130.37 51.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.2 t -93.25 112.68 26.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 121.23 0.538 . . . . 0.0 111.003 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -93.47 113.11 25.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.597 177.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.5 88.67 6.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.254 -176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 84.9 m-85 -75.79 112.79 12.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -81.93 122.9 28.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.401 -177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 71' ' ' ILE . 58.8 mt -92.07 92.09 3.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.138 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -75.01 146.01 41.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.262 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HB2' ' NZ ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -107.19 156.08 19.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.302 0.572 . . . . 0.0 111.631 -178.088 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.8 mt -95.08 149.87 20.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 165.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.68 -61.45 2.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.936 0.398 . . . . 0.0 111.28 -175.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.0 m -117.79 35.23 4.79 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.38 -107.25 2.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.02 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.86 -170.42 17.24 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.325 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.475 ' HB3' HG22 ' A' ' 61' ' ' ILE . 82.2 m-85 -101.82 138.43 38.81 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.65 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 52.4 p90 -143.93 135.31 25.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.214 0.53 . . . . 0.0 110.786 -178.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 61' ' ' ILE . 63.8 mt -82.9 -34.32 11.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.495 0.665 . . . . 0.0 109.373 174.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.5 t -126.95 154.77 44.11 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.647 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.1 m -77.88 56.01 1.49 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.164 0.507 . . . . 0.0 111.311 -175.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 74' ' ' ARG . 46.9 mtp180 -139.82 -71.6 0.38 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.656 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -105.28 104.81 14.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.207 -175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -111.7 154.58 24.76 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -136.89 137.6 39.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.912 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.8 p -69.62 -12.55 61.73 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.8 p -134.97 144.37 47.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.07 0.462 . . . . 0.0 110.061 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.0 mt -66.81 -21.74 66.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.578 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -59.52 -49.58 77.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.213 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -73.69 -26.54 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.628 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -57.29 -61.7 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.143 177.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.55 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -66.01 -44.33 92.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.599 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.79 -39.49 58.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.068 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -84.29 -40.85 17.48 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.062 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.642 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.3 m-30 -73.0 -7.87 53.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.894 0.378 . . . . 0.0 111.946 -176.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.524 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.3 m -86.1 2.33 47.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.346 0.593 . . . . 0.0 109.846 172.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -131.66 -38.32 1.16 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.48 -176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.642 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 74.8 m-70 -133.97 111.8 10.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.578 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -74.47 -35.15 63.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -173.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.7 t0 62.19 -82.41 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.891 0.744 . . . . 0.0 111.258 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -86.15 -37.5 9.07 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.837 -176.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.603 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -69.82 147.26 50.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.98 0.419 . . . . 0.0 110.913 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 70.2 m -73.22 -14.36 61.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.003 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -136.55 131.19 33.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.028 -177.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -64.68 133.97 53.27 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 172.731 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.548 HD22 ' CG ' ' A' ' 29' ' ' PHE . 81.1 mt -56.37 107.3 0.36 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.389 -176.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.6 m -96.64 -60.86 1.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.937 -172.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.432 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.6 p30 -131.89 149.47 52.43 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.19 143.53 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 54.0 t -50.71 120.45 13.14 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.63 -174.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.0 Cg_exo -71.33 130.77 17.92 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.969 2.446 . . . . 0.0 111.396 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 5.7 p -67.7 109.75 3.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.397 0.617 . . . . 0.0 110.892 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.7 m -83.59 60.19 5.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.505 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.8 pttp . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.009 179.692 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 121.35 0.595 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.38 -175.8 2.32 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.69 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.55 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 67.1 mm-40 -59.08 134.85 57.36 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' HG11 ' A' ' 101' ' ' VAL . 34.7 mt-10 -58.8 -27.53 65.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.1 -174.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.629 ' HA ' HG11 ' A' ' 101' ' ' VAL . 6.6 p-90 -104.91 -32.21 8.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.073 -175.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.558 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 58.8 t80 -90.29 111.02 22.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.796 -174.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -106.68 25.42 11.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.537 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 72.57 -150.37 44.85 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.529 -0.629 . . . . 0.0 111.529 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.8 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 15.9 pttm -107.87 71.04 0.79 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.469 0.652 . . . . 0.0 110.589 175.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 pt -73.65 149.27 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.168 172.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -77.86 167.1 22.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.231 -176.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -58.48 -44.1 89.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.82 -0.173 . . . . 0.0 110.81 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 15.9 mmm180 -53.46 -45.12 69.41 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 123.355 0.409 . . . . 0.0 110.753 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -66.17 -50.38 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.673 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.524 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 18.0 t -60.65 -51.5 69.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.356 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.599 ' HB3' HD23 ' A' ' 20' ' ' LEU . 68.9 mt-10 -77.21 -20.03 55.89 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.633 -174.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 46.4 ttp180 -61.71 -36.07 79.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.43 0.634 . . . . 0.0 109.329 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.5 mt -81.87 -44.14 17.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.034 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.582 HD21 HD22 ' A' ' 30' ' ' LEU . 78.4 mt -72.38 -28.77 63.22 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -173.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.3 mm? -82.88 19.67 1.32 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.958 0.408 . . . . 0.0 111.365 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.7 t-20 -99.59 119.69 59.42 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.2 Cg_exo -65.02 1.47 1.89 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.584 2.856 . . . . 0.0 114.521 -172.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -76.95 -16.88 59.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.409 . . . . 0.0 110.263 175.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -94.42 124.4 55.53 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.03 171.17 14.41 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.078 2.518 . . . . 0.0 112.765 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -58.88 109.66 0.87 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.62 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.43 -2.09 6.57 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.309 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 50.5 m -74.41 111.23 9.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.737 0.303 . . . . 0.0 110.327 176.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 34.5 p90 -127.26 166.39 17.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.99 0.424 . . . . 0.0 111.454 -175.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.582 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -162.32 145.27 11.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 170.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.486 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.8 p -107.87 123.78 63.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.793 0.806 . . . . 0.0 111.107 -176.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 30.4 ptt85 -126.92 138.14 53.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.348 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.8 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 7.7 tp10 -66.55 141.53 57.82 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.793 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 50.0 m -71.75 127.68 33.34 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.059 0.456 . . . . 0.0 110.023 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.625 ' HG2' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -58.43 -26.84 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.732 -175.346 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.625 HG23 ' HG2' ' A' ' 35' ' ' GLU . 17.2 p -118.66 24.21 11.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.818 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.793 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 7.3 m -141.03 137.19 32.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.869 0.366 . . . . 0.0 110.381 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -102.66 94.72 5.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.967 0.413 . . . . 0.0 110.705 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.76 50.83 2.06 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.352 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -159.19 99.3 1.48 Allowed 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 177.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.444 ' CE1' ' HE1' ' A' ' 6' ' ' TYR . 85.5 m-85 -89.92 139.41 30.62 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.705 -169.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 91.4 m -95.93 98.4 10.37 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.882 177.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.486 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.0 tm? -73.37 92.99 1.88 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 174.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 13.9 m -88.45 99.02 11.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.132 -174.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.9 p -101.97 125.38 56.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.257 0.551 . . . . 0.0 110.519 178.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.572 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 46.8 t -82.49 130.28 35.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.819 177.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.487 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 29.7 t70 -113.98 126.99 55.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.713 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -96.72 97.39 9.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.615 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -101.95 148.56 25.2 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.451 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -82.3 -20.79 36.73 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.246 -173.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -110.95 -46.33 3.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.959 0.409 . . . . 0.0 110.98 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -85.01 -15.34 44.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.201 -177.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.21 -156.61 35.91 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.825 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 22' ' ' PRO . 49.7 mt -76.95 106.29 8.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.546 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -119.56 125.38 48.67 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.711 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.14 120.02 37.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.441 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.487 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 55.3 mttm -93.59 103.03 15.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -83.37 90.05 7.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.189 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.484 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 71.7 m-85 -76.33 129.99 37.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.59 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -93.9 109.29 21.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.382 0.611 . . . . 0.0 110.844 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.484 HG12 HG12 ' A' ' 71' ' ' ILE . 68.1 mt -84.67 112.21 21.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.654 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -103.54 164.57 11.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.396 -177.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -118.08 133.7 55.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.082 0.467 . . . . 0.0 111.241 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.508 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 83.4 mt -88.06 136.76 32.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.951 175.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.67 -20.3 65.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.877 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.3 m -128.54 42.78 3.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.323 0.582 . . . . 0.0 110.627 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -168.39 -99.07 0.13 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.228 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -174.41 -147.99 6.37 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.621 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -88.14 142.5 27.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.713 0.292 . . . . 0.0 110.243 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.508 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 18.3 p90 -149.1 134.02 18.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.268 0.556 . . . . 0.0 111.049 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.578 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 70.3 mt -87.81 -26.71 5.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 169.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.3 t -146.5 152.86 39.67 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.925 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.8 m -82.19 56.24 3.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.915 0.388 . . . . 0.0 111.652 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -130.4 -54.75 1.1 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.999 0.428 . . . . 0.0 110.786 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -122.06 106.8 11.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' HD12 ' A' ' 64' ' ' LEU . 20.4 mp0 -99.58 146.37 26.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.656 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 82' ' ' GLN . 74.3 m-85 -136.98 135.98 38.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.991 0.424 . . . . 0.0 110.794 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.1 p -78.54 -27.12 45.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.089 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.458 ' HB2' ' HG3' ' A' ' 82' ' ' GLN . 4.3 m -110.47 135.79 50.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.478 . . . . 0.0 109.74 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.7 mt -65.74 -26.56 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.13 -178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -57.42 -40.83 79.17 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.23 0.538 . . . . 0.0 110.337 174.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.461 ' HB2' ' HB3' ' A' ' 77' ' ' PHE . 40.0 mt-30 -71.0 -36.56 72.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.034 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.426 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -58.06 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.711 -178.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -64.23 -42.52 95.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.076 -176.679 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.15 -50.3 71.53 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -72.89 -40.48 65.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 0.0 111.013 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.591 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.4 m-30 -75.7 -1.23 23.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.194 0.521 . . . . 0.0 111.331 -178.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.8 t -75.55 -32.73 60.53 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.153 0.501 . . . . 0.0 109.768 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -105.46 -42.2 5.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.615 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.6 t-80 -101.3 100.75 11.3 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.73 74.32 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.362 0.414 . . . . 0.0 110.645 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.429 ' HB3' ' H ' ' A' ' 93' ' ' GLY . 1.6 t0 63.61 -86.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.568 172.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.429 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -103.47 -27.47 6.43 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.249 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.1 mp -70.64 145.52 50.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 110.521 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 40.8 t -68.76 -24.52 64.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.305 176.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -136.09 136.56 40.25 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.433 ' H ' ' CD ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -72.69 145.17 47.38 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.677 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.511 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -62.94 102.73 0.38 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.403 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.6 m -87.55 -67.08 0.85 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.851 -172.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.0 p-10 -135.94 144.32 45.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.132 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.629 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -90.0 145.06 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.8 t -73.47 132.9 80.88 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.243 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -88.12 173.06 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.027 2.484 . . . . 0.0 111.694 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 15.0 p -100.87 117.8 35.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.076 0.465 . . . . 0.0 111.038 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.9 t -129.15 32.15 4.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.843 -178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp . . . . . 0 C--O 1.244 0.804 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.824 -177.895 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 121.01 0.434 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' A' ' 6' ' ' TYR . . . -143.35 92.44 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 172.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' ALA . 53.6 mt-10 70.64 -174.78 0.18 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.041 -168.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.8 -43.69 62.44 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.558 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 27.1 p-90 -66.25 -43.15 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -172.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' A' ' 2' ' ' ALA . 38.7 t80 -85.54 96.6 9.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.008 0.433 . . . . 0.0 110.502 -178.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -76.21 -62.68 1.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.342 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 138.36 -163.41 25.73 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -177.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.625 ' HB3' ' HB2' ' A' ' 33' ' ' GLU . 8.2 pttm -83.25 62.22 6.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 111.622 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 pt -78.03 132.33 32.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 169.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.3 p -74.68 177.56 6.04 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.815 -0.175 . . . . 0.0 111.399 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -58.79 -49.8 76.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -55.66 -36.01 66.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.361 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.645 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 35.9 mt-10 -78.4 -53.42 7.28 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.887 -177.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.1 p -62.21 -46.75 87.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.914 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.76 -48.52 76.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.085 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -59.11 -27.67 65.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.407 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 82.6 mt -71.88 -39.93 69.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 0.0 110.777 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.561 HD12 HG13 ' A' ' 56' ' ' VAL . 50.2 mt -87.55 -18.09 30.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.581 -175.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.2 mm? -77.73 8.01 5.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.124 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 23' ' ' GLU . 21.1 t-20 -91.19 113.0 56.84 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.529 ' HA ' HD11 ' A' ' 54' ' ' LEU . 60.5 Cg_endo -73.57 9.52 1.53 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.07 2.513 . . . . 0.0 113.501 -173.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.448 ' HB2' ' OD1' ' A' ' 21' ' ' ASN . 29.3 mt-10 -93.0 -10.28 36.82 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.498 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 91.3 m-20 -92.12 133.8 29.64 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.636 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 22.5 Cg_exo -65.39 160.89 40.4 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.183 2.589 . . . . 0.0 112.951 -177.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.694 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 57.3 ttp180 -72.15 120.19 17.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.754 175.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.64 6.21 25.24 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.837 -176.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 87.7 m -73.06 117.21 14.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CZ ' HG22 ' A' ' 101' ' ' VAL . 28.2 p90 -121.19 161.5 21.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.992 0.425 . . . . 0.0 111.923 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -166.16 135.02 3.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.127 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -99.49 125.3 53.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.602 0.715 . . . . 0.0 110.704 -178.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.592 ' CG ' ' HB2' ' A' ' 42' ' ' CYS . 5.4 ptm180 -112.3 148.19 34.72 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.939 -176.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.625 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 46.7 mt-10 -67.32 120.08 13.24 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 170.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.2 t -75.08 74.82 2.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 57.1 33.53 23.47 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.357 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.525 ' OG1' ' HD3' ' A' ' 9' ' ' LYS . 3.1 m 54.5 38.18 29.23 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.808 -176.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.1 m -79.16 103.85 9.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -61.51 124.06 19.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.919 0.39 . . . . 0.0 110.124 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.458 ' O ' ' HD2' ' A' ' 62' ' ' ARG . . . 106.89 -5.49 36.78 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.118 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -143.3 108.15 4.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.178 0.513 . . . . 0.0 111.254 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -118.5 139.66 51.09 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.592 ' HB2' ' CG ' ' A' ' 32' ' ' ARG . 35.7 m -97.63 104.56 16.59 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.052 -176.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.47 97.16 7.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 t -93.63 134.72 35.64 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.113 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 p -133.13 141.36 44.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.517 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 p -78.34 115.23 17.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.251 0.548 . . . . 0.0 111.074 -178.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.674 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 10.5 t70 -95.37 139.18 32.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.978 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.694 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 94.1 t80 -109.86 130.13 55.56 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.075 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -124.08 143.99 50.13 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -88.98 -8.37 54.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.148 0.499 . . . . 0.0 110.84 -172.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.15 -45.15 3.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.572 177.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -86.6 -37.09 18.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.434 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 114.93 -90.5 0.53 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.779 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.529 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.3 mt -130.19 147.62 51.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.021 0.438 . . . . 0.0 111.331 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -134.68 149.54 50.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.109 174.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.561 HG13 HD12 ' A' ' 19' ' ' LEU . 39.0 t -107.75 114.8 47.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.968 0.413 . . . . 0.0 110.471 178.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.674 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 67.0 mttm -95.42 108.18 20.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.356 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -88.7 88.86 7.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.92 0.391 . . . . 0.0 110.696 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -78.09 92.17 4.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.34 126.84 30.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.62 0.724 . . . . 0.0 110.932 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 71' ' ' ILE . 70.1 mt -96.12 127.61 48.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.909 -176.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 39' ' ' GLY . 24.2 tpt180 -99.31 140.86 32.87 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 28.1 ttpp -87.34 127.56 35.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' H ' ' A' ' 66' ' ' SER . 21.6 tp -75.53 125.93 30.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.556 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -60.8 -29.43 69.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.354 0.597 . . . . 0.0 109.891 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.507 ' H ' ' HG ' ' A' ' 64' ' ' LEU . 4.9 m -85.05 -45.42 12.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.998 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.425 ' H ' ' CG ' ' A' ' 64' ' ' LEU . . . -118.77 -109.1 2.37 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.118 -1.039 . . . . 0.0 113.154 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -130.46 -101.1 0.9 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.177 -173.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -133.07 150.4 52.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.645 0.259 . . . . 0.0 110.889 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -161.23 140.2 10.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.237 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 61' ' ' ILE . 55.9 mt -85.08 -27.99 6.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.36 0.6 . . . . 0.0 110.071 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 74' ' ' ARG . 4.4 t -151.06 150.86 31.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.86 -178.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.8 m -78.32 58.89 2.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.25 0.548 . . . . 0.0 111.504 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.669 ' HG2' HG23 ' A' ' 72' ' ' THR . 15.8 ptp180 -142.47 -28.71 0.59 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.936 175.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 36.9 m -139.2 124.49 19.12 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.549 177.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -126.23 144.53 50.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.741 -174.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.508 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 75.0 m-85 -130.96 179.53 5.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.744 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.41 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 14.3 m -95.13 -38.74 10.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.572 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 83.4 p -122.89 166.95 14.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.999 0.428 . . . . 0.0 110.666 -177.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.626 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.1 mt -77.62 -17.1 58.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.993 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -48.03 64.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.312 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -61.04 -37.75 83.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.788 176.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.651 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -54.13 -66.55 0.38 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.089 . . . . 0.0 110.709 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -61.34 -43.33 96.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -176.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.51 -42.17 77.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.988 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -82.32 -40.09 21.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.162 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.0 m-85 -74.63 -4.62 38.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.112 0.482 . . . . 0.0 111.194 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.3 t -76.91 -26.46 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.544 0.687 . . . . 0.0 109.427 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -101.88 -47.63 4.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.796 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 10.6 t-80 -113.14 109.63 19.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.795 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.62 88.85 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.339 0.399 . . . . 0.0 110.8 -177.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.422 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 37.6 t70 67.52 -78.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.089 0.868 . . . . 0.0 112.5 169.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -106.14 -37.18 2.55 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.933 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.62 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.14 145.81 54.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.3 0.571 . . . . 0.0 110.966 178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.23 -19.25 59.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.079 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -127.81 125.4 39.73 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 97' ' ' ARG . 7.2 ptp180 -69.75 153.12 43.81 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.477 HD22 ' CG ' ' A' ' 29' ' ' PHE . 63.4 mt -74.45 94.82 2.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.01 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.2 p -89.12 -78.2 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.725 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -111.07 145.25 38.85 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.544 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -88.37 138.06 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.4 t -55.73 124.4 56.87 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.397 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.52 133.35 23.99 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.068 1.846 . . . . 0.0 110.927 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.0 t -66.56 150.01 49.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.152 0.501 . . . . 0.0 109.796 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.4 m -104.44 126.28 51.4 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.725 -170.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 65.1 tttp . . . . . 0 C--O 1.253 1.251 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.637 175.164 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 121.249 0.547 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.41 89.37 6.6 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.899 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -68.41 140.28 55.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.486 -179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -47.75 -53.17 16.03 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -170.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.5 p-90 -64.9 -40.9 95.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.489 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -85.48 85.51 7.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.102 0.477 . . . . 0.0 110.218 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 6.9 m-85 -67.75 -13.59 62.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.663 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 99.84 -148.03 18.4 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.983 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -95.79 50.52 1.21 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 0.0 110.801 -175.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.3 pt -75.02 147.31 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.7 p -73.85 157.32 36.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.074 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -56.9 -35.3 68.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.984 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 30.3 ttp180 -50.58 -57.18 8.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.874 174.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 27.4 mt-10 -68.61 -45.04 73.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.972 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.2 t -53.7 -58.58 6.68 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.708 -175.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.683 ' HB2' HG11 ' A' ' 56' ' ' VAL . 2.2 pt-20 -73.97 -36.02 64.54 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.456 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -56.73 -38.27 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.724 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 94.2 mt -63.65 -39.18 93.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.666 176.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.512 HD12 HG13 ' A' ' 56' ' ' VAL . 30.4 mt -77.25 -15.75 59.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.152 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.564 HD22 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -76.71 -4.42 43.19 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 122.231 -0.293 . . . . 0.0 111.6 175.691 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -73.87 110.66 9.68 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -57.21 -14.52 15.51 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.487 2.791 . . . . 0.0 113.998 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.49 -10.67 59.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 1.2 p30 -98.89 138.49 20.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 178.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 83.2 Cg_endo -88.09 173.15 5.0 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 123.198 2.599 . . . . 0.0 113.566 -176.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.432 ' HD3' ' ND1' ' A' ' 96' ' ' HIS . 26.1 ttm180 -68.5 128.35 36.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.747 176.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -5.0 22.36 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.562 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.63 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 33.0 m -73.34 130.36 40.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CG ' HD22 ' A' ' 98' ' ' LEU . 42.1 p90 -141.63 161.54 37.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.795 0.331 . . . . 0.0 111.501 -176.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.7 pt? -159.67 143.9 14.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.551 173.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -111.96 121.08 63.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.458 0.647 . . . . 0.0 110.801 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 32' ' ' ARG . 22.9 ptt85 -108.65 143.16 38.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.928 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -78.5 100.87 7.07 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.63 176.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -80.62 76.6 7.48 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -5.2 6.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.958 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -69.38 -26.57 64.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.283 0.563 . . . . 0.0 109.767 171.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.0 m -139.22 92.18 2.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.423 176.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -60.83 120.81 10.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.999 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 107.43 -6.27 36.07 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.196 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -114.49 95.61 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.323 0.582 . . . . 0.0 110.565 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.748 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.7 m-85 -87.07 148.97 25.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.904 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 59.3 m -109.39 106.12 15.78 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.665 -178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.709 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.4 tm? -86.82 90.48 8.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 174.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.3 t -81.89 129.73 34.85 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.463 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.25 143.18 41.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 120.932 0.396 . . . . 0.0 110.676 -176.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -83.44 113.82 21.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.114 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.592 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 8.2 t70 -93.92 142.58 27.22 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -126.51 118.1 24.22 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.958 0.409 . . . . 0.0 110.54 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -129.2 144.01 51.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.868 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -89.45 31.72 0.9 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.947 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -137.26 -49.57 0.61 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.304 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -99.16 -8.32 25.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.157 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.51 -134.92 12.87 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.232 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.1 mp -88.26 131.03 34.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.797 0.332 . . . . 0.0 110.59 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.592 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 30.8 m-80 -119.94 130.65 54.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.683 HG11 ' HB2' ' A' ' 16' ' ' GLU . 84.8 t -102.32 116.43 45.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.294 0.569 . . . . 0.0 111.022 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -109.62 116.99 32.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.331 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -89.07 99.79 12.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.878 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB3' HG23 ' A' ' 71' ' ' ILE . 31.3 m-85 -79.49 155.19 28.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.21 0.529 . . . . 0.0 111.424 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 1.9 mtmt -98.25 107.84 20.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.18 -169.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 71' ' ' ILE . 35.7 mt -99.01 75.71 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -98.28 133.64 42.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.462 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 27.8 ttmt -71.96 139.42 48.66 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.888 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.25 147.92 51.54 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 169.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -45.47 -47.3 14.0 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.639 0.587 . . . . 0.0 111.375 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.0 m -139.86 48.4 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.971 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -134.06 -107.34 0.97 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.354 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -151.24 -170.66 18.43 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.786 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 95.6 m-85 -91.01 141.23 29.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.695 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 53.5 p90 -145.11 143.57 30.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.648 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 61' ' ' ILE . 54.4 mt -90.95 -21.82 6.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 122.014 0.911 . . . . 0.0 108.934 172.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.659 HG21 ' HB3' ' A' ' 92' ' ' ASP . 4.2 t -149.29 153.49 37.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.541 -1.209 . . . . 0.0 109.13 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 m -78.37 46.79 0.65 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 111.828 -174.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -131.13 -67.03 0.72 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.275 0.56 . . . . 0.0 109.592 178.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.1 m -103.95 148.96 25.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.534 177.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.9 pt20 -159.48 148.69 18.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.599 0.237 . . . . 0.0 110.92 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -137.38 149.97 47.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 111.033 -176.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.8 t -82.69 -15.12 53.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.869 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.6 m -128.32 141.58 51.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.7 mt -67.6 -27.51 66.97 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.483 -173.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -66.82 -46.66 74.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.36 -30.68 71.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.654 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -54.03 -68.04 0.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.866 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -61.98 -42.64 95.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.889 -177.285 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.21 -47.2 72.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.082 -179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -81.0 -33.66 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.421 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 26.5 m-85 -70.85 -7.35 44.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.955 0.407 . . . . 0.0 111.465 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.1 m -79.86 -16.85 54.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.661 171.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -109.4 -27.36 9.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.33 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 0.1 OUTLIER -131.42 105.23 7.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.751 -176.591 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.4 ' HB2' ' HB3' ' A' ' 97' ' ' ARG . . . -72.48 -41.18 66.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.792 0.33 . . . . 0.0 110.864 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.659 ' HB3' HG21 ' A' ' 72' ' ' THR . 0.8 OUTLIER 59.89 -87.43 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.797 176.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -95.12 -30.57 8.19 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.112 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.625 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -68.96 141.49 54.94 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.148 177.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.1 -17.3 62.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.628 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.432 ' ND1' ' HD3' ' A' ' 26' ' ' ARG . 80.6 m-70 -137.26 130.28 30.65 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 91' ' ' ALA . 16.8 ptp180 -71.65 148.98 45.98 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.559 HD22 ' CG ' ' A' ' 29' ' ' PHE . 54.0 mt -62.39 120.09 10.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.546 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.5 m -111.43 -60.68 1.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.081 0.467 . . . . 0.0 110.933 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.63 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.9 p-10 -133.25 141.63 48.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.686 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.401 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -79.9 149.89 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -177.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.5 t -55.15 121.58 37.36 Favored Pre-proline 0 C--N 1.328 -0.349 0 O-C-N 123.645 0.591 . . . . 0.0 110.775 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -83.54 138.12 8.31 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.54 2.16 . . . . 0.0 111.515 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.4 p -68.09 127.34 32.51 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 p -63.62 123.61 19.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.57 -175.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 C--O 1.248 1.01 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.002 -179.739 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.811 0.338 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.02 166.19 29.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.94 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -118.78 123.0 43.73 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -53.92 -34.61 60.07 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -166.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.6 p-90 -82.33 -35.86 27.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.491 ' CE2' ' HA2' ' A' ' 8' ' ' GLY . 64.9 t80 -87.22 109.29 19.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.967 0.413 . . . . 0.0 110.721 -177.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.613 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 40.0 m-85 -96.86 19.85 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.224 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.491 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 65.55 -141.53 42.57 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.357 177.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.616 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 58.8 mtmt -107.35 87.82 2.59 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.178 0.513 . . . . 0.0 110.848 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.8 pt -103.19 155.7 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.305 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 p -84.94 174.77 9.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 12' ' ' ARG . 18.6 mtm180 -59.67 -48.44 81.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.103 -177.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -54.96 -43.13 73.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.015 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.08 -52.25 66.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.003 0.43 . . . . 0.0 110.669 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -67.35 -47.98 68.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.143 -176.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.64 -42.08 87.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.57 -175.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -55.72 -41.47 73.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.075 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.85 -44.32 55.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.336 -177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD11 ' CD2' ' A' ' 30' ' ' LEU . 79.0 mt -78.4 -26.35 46.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -172.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' A' ' 20' ' ' LEU . 4.0 mm? -81.2 3.85 22.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 111.448 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.46 ' C ' ' H ' ' A' ' 23' ' ' GLU . 94.3 m-20 -73.99 138.02 76.1 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.85 30.37 0.29 Allowed 'Trans proline' 0 N--CA 1.472 0.222 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 21' ' ' ASN . 33.5 mt-10 -121.37 7.47 10.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.72 -178.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 48.7 m-80 -107.54 115.06 59.94 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.569 -178.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 52.1 Cg_endo -69.04 145.8 62.52 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.462 2.108 . . . . 0.0 110.444 170.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.692 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 55.2 ttp180 -60.71 114.67 3.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.25 6.15 7.64 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.35 -172.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.792 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 94.2 m -84.27 112.47 20.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.75 0.31 . . . . 0.0 110.316 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 33.5 p90 -117.09 158.28 24.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.055 0.455 . . . . 0.0 112.114 -171.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.613 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.8 pt? -154.02 138.05 16.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 170.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.61 118.26 55.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.446 0.641 . . . . 0.0 110.869 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -111.13 149.39 30.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.825 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 44.1 tt0 -92.43 130.5 38.09 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -107.51 98.54 8.14 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -72.21 -1.99 17.15 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.378 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.8 p -64.92 -19.48 65.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.601 0.715 . . . . 0.0 109.756 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.79 159.91 22.25 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.082 176.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -80.17 71.9 6.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.124 0.488 . . . . 0.0 110.811 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.37 32.23 12.32 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.843 176.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.67 141.17 30.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.92 0.391 . . . . 0.0 110.18 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.0 m-85 -117.3 165.4 13.51 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.54 -175.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.0 m -127.66 108.58 10.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.135 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.597 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.5 tm? -89.95 90.57 8.22 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.0 m -89.11 123.29 33.25 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.473 ' CG1' ' HB2' ' A' ' 57' ' ' LYS . 14.3 p -112.22 130.31 66.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.229 177.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 28' ' ' THR . 46.8 t -68.03 121.69 16.64 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.692 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 16.5 t70 -122.15 154.5 37.33 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.741 -170.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -135.87 95.8 3.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.502 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.51 118.18 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -75.1 60.53 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.66 0.743 . . . . 0.0 109.765 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.08 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.433 -1.258 . . . . 0.0 108.705 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -108.3 -63.7 1.3 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.81 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.74 -151.86 21.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.875 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.2 128.38 35.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.254 -178.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -151.59 177.53 10.25 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.21 119.95 59.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.664 0.269 . . . . 0.0 110.885 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 52.8 mttp -87.24 103.94 15.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -84.75 86.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.277 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.6 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 45.7 m-85 -72.41 127.77 33.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.178 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.406 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 23.7 pttm -83.39 124.84 31.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.042 0.449 . . . . 0.0 111.403 -176.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 71' ' ' ILE . 57.3 mt -102.25 106.33 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.676 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.439 ' HD2' HH11 ' A' ' 62' ' ' ARG . 11.4 mmt85 -108.81 172.18 6.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.224 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 51.9 mtmt -123.9 157.74 33.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.197 0.522 . . . . 0.0 111.659 -177.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.42 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 60.1 mt -123.51 151.09 43.17 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.724 178.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.33 -64.71 0.74 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 111.145 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 65.8 m -103.1 22.46 13.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.118 0.485 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 64' ' ' LEU . . . -112.97 -97.02 2.28 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.644 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 158.79 -149.69 19.92 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.61 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -80.75 126.6 31.51 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.5 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 30.3 p90 -140.48 141.15 35.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.249 0.547 . . . . 0.0 110.271 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 61' ' ' ILE . 23.9 mt -101.84 -6.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 122.31 1.053 . . . . 0.0 108.546 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.938 HG21 ' HA3' ' A' ' 93' ' ' GLY . 2.5 t -169.5 160.01 8.86 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.649 -173.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.2 p -74.12 0.38 14.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.757 0.313 . . . . 0.0 111.011 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -67.82 -54.73 16.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.443 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m -142.25 141.35 32.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.872 -174.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.5 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 24.7 mp0 -125.19 138.1 54.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.93 178.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -130.75 140.74 50.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 0.0 111.191 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.7 p -82.22 -8.63 59.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.332 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 24.7 m -131.23 132.73 44.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.032 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.561 ' O ' HG22 ' A' ' 84' ' ' VAL . 53.4 mt -64.65 -30.32 71.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.871 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.72 -46.15 84.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.329 175.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 7.9 mm-40 -77.0 -21.25 54.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -178.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.496 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -62.59 -59.69 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.509 174.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.93 -42.03 88.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.945 -178.215 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.0 -22.09 62.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -91.73 -48.88 6.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.739 0.304 . . . . 0.0 110.591 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.722 ' HD2' ' HG ' ' A' ' 94' ' ' LEU . 7.0 m-85 -73.13 -5.47 39.32 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.789 -176.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.9 p -78.67 -33.0 47.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.261 0.553 . . . . 0.0 110.244 173.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -95.8 -51.65 4.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.141 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.408 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 4.7 t-80 -120.89 107.27 12.49 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.323 177.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -62.58 -37.5 86.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.479 -176.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.41 -72.27 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.193 172.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.938 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -104.01 -22.68 8.63 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.722 ' HG ' ' HD2' ' A' ' 87' ' ' TYR . 15.4 mt -79.42 155.5 28.32 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 35.4 t -82.39 -29.18 30.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.34 0.59 . . . . 0.0 109.937 177.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -127.34 125.62 41.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.36 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -72.41 137.72 46.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.016 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.592 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 59.6 mt -61.42 100.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.791 -174.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -97.73 -53.38 3.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.697 -173.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.792 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 t30 -127.08 136.07 51.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.965 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -87.01 148.31 4.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.862 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.2 t -50.73 125.21 21.25 Favored Pre-proline 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 111.659 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -69.73 144.87 55.61 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.021 2.481 . . . . 0.0 111.749 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.4 p -102.65 158.63 16.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.107 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 3.1 p -80.21 59.68 3.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.465 0.65 . . . . 0.0 110.009 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt . . . . . 0 C--O 1.25 1.102 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.566 -177.175 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 121.907 0.86 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.49 65.48 0.88 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.676 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -83.26 -163.3 0.72 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.635 -170.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.453 ' O ' HG11 ' A' ' 101' ' ' VAL . 50.1 mt-10 -57.11 -40.77 77.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.045 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.624 ' HA ' HG11 ' A' ' 101' ' ' VAL . 4.6 p-90 -84.19 -41.62 16.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.508 ' HE1' ' HA2' ' A' ' 8' ' ' GLY . 2.6 t80 -85.41 104.36 15.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.665 -174.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -94.68 -2.66 50.82 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.508 ' HA2' ' HE1' ' A' ' 6' ' ' TYR . . . 79.14 -169.31 53.9 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.795 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 51.9 pttt -67.1 98.75 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 110.982 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.1 pt -125.66 141.58 45.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.486 172.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.2 p -73.73 152.37 40.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.258 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -60.01 -34.94 74.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.016 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.631 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 11.5 ptm180 -55.03 -41.88 71.91 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.334 0.396 . . . . 0.0 111.007 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HG2' ' HG3' ' A' ' 13' ' ' ARG . 4.9 mm-40 -82.17 -47.61 12.3 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 33.3 t -59.17 -49.3 78.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.674 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB2' HG11 ' A' ' 56' ' ' VAL . 3.9 pt-20 -79.9 -31.49 40.21 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.23 -174.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.631 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 24.0 ttm180 -58.13 -36.53 73.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 174.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.793 HD21 ' HB2' ' A' ' 105' ' ' SER . 71.0 mt -60.48 -44.77 95.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.976 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.521 HD12 HG13 ' A' ' 56' ' ' VAL . 44.7 mt -74.79 -22.92 58.48 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.779 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.458 HD22 HG23 ' A' ' 56' ' ' VAL . 2.1 mm? -74.03 -7.95 54.33 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.419 175.103 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.425 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 94.0 m-20 -80.42 119.95 77.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HA ' HD11 ' A' ' 54' ' ' LEU . 13.1 Cg_exo -70.35 44.61 0.47 Allowed 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.484 2.789 . . . . 0.0 113.156 -177.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -115.39 -0.46 13.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.948 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -123.09 145.42 45.98 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.152 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -87.62 172.06 5.87 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.954 2.436 . . . . 0.0 112.439 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -64.15 125.73 25.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.927 177.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.54 12.14 21.84 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.327 -0.94 . . . . 0.0 112.126 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.54 ' HB ' ' OG ' ' A' ' 46' ' ' SER . 32.6 m -81.75 116.31 21.39 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 173.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.469 ' CG ' HD22 ' A' ' 98' ' ' LEU . 38.2 p90 -121.9 168.61 11.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.769 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.71 127.96 3.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 171.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.499 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -91.34 109.61 21.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.023 0.916 . . . . 0.0 110.088 177.618 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.482 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 18.7 ptt180 -109.49 153.98 23.3 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.587 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.61 152.48 24.8 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.748 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 3.0 p -59.8 125.66 24.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.89 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.07 -53.27 7.59 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.738 -175.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.9 p -108.88 -11.42 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.219 0.533 . . . . 0.0 110.474 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.748 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 6.0 m -91.61 158.93 16.14 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.514 -0.767 . . . . 0.0 108.958 175.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -118.41 80.28 1.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.143 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.11 54.51 0.52 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.389 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.84 88.84 1.13 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.158 0.504 . . . . 0.0 109.868 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.615 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 64.6 m-85 -64.0 141.22 58.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.077 -175.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.482 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 48.5 t -109.22 107.08 17.21 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.142 0.496 . . . . 0.0 110.576 -177.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -86.93 87.58 7.49 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t -87.06 132.2 33.88 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.6 p -126.46 140.15 49.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.874 0.368 . . . . 0.0 110.23 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.54 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 97.8 p -88.28 139.54 30.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.144 -178.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -123.87 126.87 47.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.325 0.583 . . . . 0.0 110.28 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -106.91 89.19 2.93 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.686 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.84 152.14 20.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.287 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -100.16 10.42 41.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.043 -174.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.01 -42.28 2.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.023 0.439 . . . . 0.0 110.425 176.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.54 -36.01 10.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.592 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 106.59 -156.77 16.05 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.967 -0.635 . . . . 0.0 111.57 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.438 HD11 ' HA ' ' A' ' 22' ' ' PRO . 20.7 mt -69.9 124.46 24.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.882 0.372 . . . . 0.0 110.965 177.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -136.56 146.41 46.12 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.521 HG13 HD12 ' A' ' 19' ' ' LEU . 86.4 t -109.51 127.83 66.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.29 0.567 . . . . 0.0 111.217 -175.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -107.65 98.9 8.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.085 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -79.15 95.99 5.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.228 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.533 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 69.5 m-85 -84.8 148.29 26.4 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -114.31 122.05 45.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.092 0.473 . . . . 0.0 111.562 -173.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.615 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 83.5 mt -89.47 93.89 4.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.309 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 ttp85 -96.21 156.29 16.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -74.6 146.13 42.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.419 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.715 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 1.4 tt -53.79 -60.5 3.23 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.689 0.757 . . . . 0.0 109.884 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.5 t70 174.12 -30.29 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 113.477 -1.692 . . . . 0.0 107.582 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -125.39 -62.33 1.21 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.67 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.39 67.5 0.25 Allowed Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.951 -1.119 . . . . 0.0 113.265 -176.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -150.59 140.85 8.22 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -109.24 133.1 53.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.216 0.508 . . . . 0.0 110.098 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.715 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 53.6 p90 -148.03 149.07 31.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.523 HG12 HG12 ' A' ' 61' ' ' ILE . 58.3 mt -95.98 -20.89 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.978 0.894 . . . . 0.0 109.156 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -148.61 147.75 29.33 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.911 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m -76.12 55.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -138.49 -35.54 0.6 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -126.01 120.41 30.22 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.16 -0.216 . . . . 0.0 110.522 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -114.78 136.74 52.75 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -124.06 153.78 40.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.409 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.6 m -92.46 -19.4 22.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.091 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.2 p -131.16 145.7 52.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.951 0.405 . . . . 0.0 110.503 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.516 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.9 mt -75.89 -21.75 56.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -63.25 -43.11 98.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.168 175.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -73.24 -27.1 61.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.603 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.432 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -57.98 -62.81 1.55 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.064 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -63.63 -42.62 96.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -176.643 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.43 92.8 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.697 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -75.88 -42.19 49.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.876 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.576 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.1 m-85 -76.25 0.64 18.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.23 0.538 . . . . 0.0 111.79 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 t -80.97 -30.28 35.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 170.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -96.06 -40.08 9.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.853 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.576 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 3.5 m-70 -110.18 113.08 25.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.291 177.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.28 82.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.764 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.9 t70 68.23 -70.74 0.12 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.532 -1.213 . . . . 0.0 112.116 168.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -131.02 -29.71 0.6 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.331 -0.462 . . . . 0.0 111.981 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.574 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -60.93 -39.84 90.95 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.84 0.829 . . . . 0.0 112.275 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.4 t 83.17 -29.65 0.09 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 112.429 -2.169 . . . . 0.0 110.162 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -97.01 124.68 41.05 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 172.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.78 141.67 44.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.289 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CG ' ' A' ' 29' ' ' PHE . 66.8 mt -66.09 94.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.002 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.1 m -91.8 -63.81 1.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -172.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.4 p30 -133.24 163.35 29.49 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.624 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.4 t -102.26 145.64 11.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.026 0.441 . . . . 0.0 110.892 -174.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.9 t -57.74 137.29 82.87 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.43 -176.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 4.8 Cg_exo -76.33 176.54 9.93 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.527 2.818 . . . . 0.0 112.004 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 14.2 p -90.69 164.78 14.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.216 -178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.793 ' HB2' HD21 ' A' ' 18' ' ' LEU . 27.5 t -88.88 150.36 22.91 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 111.749 -173.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.7 pttt . . . . . 0 C--O 1.252 1.195 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.742 173.897 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.23 96.27 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.973 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -86.69 -179.33 6.56 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.915 -177.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -56.27 -48.46 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.38 0.61 . . . . 0.0 110.216 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.676 ' HA ' HG11 ' A' ' 101' ' ' VAL . 8.4 p-90 -89.55 -44.3 10.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.3 -177.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.463 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 3.2 t80 -82.32 86.36 6.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.404 -175.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.556 ' CE2' ' HB ' ' A' ' 104' ' ' THR . 11.2 m-85 -69.86 -31.5 69.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.26 0.552 . . . . 0.0 110.847 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.8 -148.35 18.9 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.355 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -83.76 68.8 10.04 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.73 0.3 . . . . 0.0 111.343 -174.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.7 pt -95.47 150.01 4.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 p -82.3 166.38 19.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -71.06 -20.71 62.33 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -65.18 -44.79 87.34 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.57 -51.97 24.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.708 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 t -51.89 -68.42 0.17 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.624 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -29.29 66.61 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -61.25 -58.05 9.88 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.195 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 mp -63.96 -36.51 84.2 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.699 HD21 HD22 ' A' ' 30' ' ' LEU . 89.3 mt -70.54 -40.93 73.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.648 -177.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.33 57.96 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.324 0.583 . . . . 0.0 111.023 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 4.7 m-20 -121.08 119.25 29.83 Favored Pre-proline 0 C--N 1.321 -0.664 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 172.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 31.8 Cg_exo -60.28 -11.67 17.13 Favored 'Trans proline' 0 N--CA 1.473 0.321 0 C-N-CA 123.283 2.655 . . . . 0.0 113.187 -176.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -79.61 -19.15 49.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.95 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -87.92 130.31 47.06 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.046 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -84.85 166.99 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.683 2.255 . . . . 0.0 112.58 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.48 ' HD2' ' CE1' ' A' ' 96' ' ' HIS . 53.1 ttp180 -57.1 128.74 38.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.447 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.66 1.3 30.71 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.902 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 70.9 m -77.66 119.88 21.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 175.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.4 p90 -134.45 174.08 10.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.909 0.385 . . . . 0.0 111.74 -173.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.699 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -171.13 147.59 2.58 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.036 171.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -101.26 118.08 47.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.443 0.64 . . . . 0.0 110.771 179.261 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.429 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 18.1 ptt180 -117.31 155.71 29.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.121 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -99.63 135.83 40.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.002 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.451 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 43.1 t -84.71 121.6 27.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.009 0.433 . . . . 0.0 111.097 -178.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -81.0 -18.18 47.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.48 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.59 -28.19 26.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.747 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 61.7 m -135.06 93.24 2.97 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.194 0.521 . . . . 0.0 110.627 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 34' ' ' SER . 14.3 mmmm -71.72 113.23 8.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.851 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 122.62 3.13 9.43 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.49 -175.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.97 116.67 10.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.013 0.435 . . . . 0.0 109.908 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.794 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 17.4 m-85 -92.66 161.64 14.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.655 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.429 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 60.8 m -118.67 101.32 8.02 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.969 0.414 . . . . 0.0 110.71 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.3 tm? -77.56 97.95 5.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 5.0 m -92.34 105.63 17.79 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.122 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -113.56 136.67 49.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.043 0.449 . . . . 0.0 110.892 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.6 t -86.96 127.15 35.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.481 0.658 . . . . 0.0 110.632 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.454 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 7.4 t70 -112.34 140.08 47.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.791 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.434 ' CB ' ' HB2' ' A' ' 26' ' ' ARG . 78.9 t80 -111.11 114.88 28.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.091 0.472 . . . . 0.0 110.457 -176.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -112.35 153.75 26.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.072 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -75.51 -20.23 58.86 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.997 -172.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -112.25 -49.41 2.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -80.35 -17.48 51.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -176.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.71 -146.05 28.11 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.869 -0.682 . . . . 0.0 111.891 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.33 125.12 28.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.89 0.376 . . . . 0.0 110.373 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -131.37 138.11 49.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 77.9 t -98.64 124.23 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.165 0.507 . . . . 0.0 110.91 -176.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 57.0 mttm -102.88 116.68 33.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.974 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -91.69 94.94 9.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.583 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.493 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 62.3 m-85 -77.14 128.95 35.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.347 178.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -81.84 116.65 21.61 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 -176.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.794 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.5 mt -96.44 84.09 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 70' ' ' TYR . 43.9 ttm180 -90.12 139.04 31.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.474 . . . . 0.0 111.328 -172.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . 51.4 tttp -90.13 133.3 34.96 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.352 177.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.2 -81.36 0.13 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 177.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -170.13 -64.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.419 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 34.0 p -120.25 -23.28 6.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.714 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -64.7 -52.47 42.37 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.216 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.16 -147.64 19.32 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.344 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.612 ' CE2' ' HB2' ' A' ' 63' ' ' LYS . 84.2 m-85 -108.87 141.27 41.17 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.614 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 48.9 p90 -135.53 143.66 45.86 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.289 0.566 . . . . 0.0 111.398 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.528 HG12 HG12 ' A' ' 61' ' ' ILE . 61.3 mt -95.08 -24.78 4.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.914 171.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.3 t -133.6 149.64 51.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.2 m -78.39 59.73 2.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.932 -174.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 74' ' ' ARG . 13.8 ptt180 -169.28 -47.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.817 173.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.3 m -99.93 130.06 46.07 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.8 pt20 -149.66 153.9 37.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.749 0.309 . . . . 0.0 111.281 -174.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.47 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 93.2 m-85 -139.0 141.57 38.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.618 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.0 p -80.97 -10.8 59.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.617 0.246 . . . . 0.0 111.658 -174.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.5 m -132.29 138.48 47.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.643 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.11 -31.65 72.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.91 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -59.1 -48.64 80.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.611 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.415 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 14.4 mm-40 -65.56 -40.72 93.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.647 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.496 HD13 ' N ' ' A' ' 84' ' ' VAL . 1.3 tm? -51.04 -57.98 7.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.615 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.496 ' N ' HD13 ' A' ' 83' ' ' LEU . 9.2 p -75.64 -42.44 41.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.515 -170.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.84 83.96 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.335 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -76.66 -42.99 39.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.854 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.554 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -74.86 -16.66 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -175.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.743 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 79.8 p -69.41 -14.57 62.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.795 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -113.2 -59.23 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.354 0.597 . . . . 0.0 109.543 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 92' ' ' ASP . 6.5 t60 -98.84 95.33 7.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.796 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.85 -31.12 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 0.0 111.564 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.696 ' HB2' ' HD2' ' A' ' 90' ' ' HIS . 5.5 t70 53.3 -88.08 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.827 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.51 -43.62 12.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.408 -177.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.657 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -67.99 137.17 54.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.888 0.375 . . . . 0.0 110.81 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.72 -19.92 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.522 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.48 ' CE1' ' HD2' ' A' ' 26' ' ' ARG . 94.0 m-70 -120.03 139.51 52.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.455 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -74.76 134.21 41.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.669 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.743 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 84.9 mt -62.18 99.67 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.147 0.499 . . . . 0.0 109.783 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.7 m -84.73 -63.97 1.24 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.827 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.3 p30 -137.71 143.42 41.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.809 0.337 . . . . 0.0 110.22 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.676 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.9 t -88.3 132.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.4 t -65.4 128.35 93.72 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.58 147.09 35.39 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.491 2.127 . . . . 0.0 112.043 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.556 ' HB ' ' CE2' ' A' ' 7' ' ' PHE . 5.5 t -91.19 158.61 16.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 0.0 110.817 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.3 m -135.2 27.67 3.47 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.435 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.545 -0.74 . . . . 0.0 109.072 178.153 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 . . . . . 0 N--CA 1.484 1.233 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.89 74.8 0.36 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.637 0.586 . . . . 0.0 110.719 178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 6' ' ' TYR . 20.9 mt-10 -127.89 -143.99 0.29 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.04 -174.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 30.2 mt-10 74.14 -47.94 0.65 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.829 0.852 . . . . 0.0 110.313 -171.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' HE3' HG11 ' A' ' 31' ' ' VAL . 1.4 p-90 -89.76 -32.99 16.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.739 ' HB3' ' HA ' ' A' ' 3' ' ' GLU . 3.1 t80 -80.09 94.31 5.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.826 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.539 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 35.4 m-85 -85.75 -13.08 49.4 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.922 0.392 . . . . 0.0 111.133 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.29 -153.51 29.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.645 176.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.509 ' CG ' ' HB2' ' A' ' 33' ' ' GLU . 30.4 mtmm -82.04 53.88 2.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.856 0.36 . . . . 0.0 111.819 -175.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.463 HD13 ' HB3' ' A' ' 7' ' ' PHE . 34.2 pt -77.5 140.89 16.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 173.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -70.14 163.67 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' ' NH1' ' A' ' 32' ' ' ARG . 13.4 ptp180 -57.29 -32.78 66.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.212 0.529 . . . . 0.0 110.153 176.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -60.84 -49.07 78.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.346 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -67.94 -57.35 6.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.32 -177.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.454 ' HB3' ' CD1' ' A' ' 10' ' ' ILE . 5.4 p -62.17 -52.39 64.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.864 -172.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.43 -29.21 61.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -172.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.437 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 17.0 tpt180 -69.09 -29.58 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.95 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.31 -43.21 86.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 46' ' ' SER . 6.3 mp -74.8 -31.5 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.48 ' HA ' HD13 ' A' ' 20' ' ' LEU . 2.9 mm? -78.77 -7.68 58.03 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.098 0.406 . . . . 0.0 112.098 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.48 ' OD1' ' HD2' ' A' ' 22' ' ' PRO . 63.1 t30 -68.78 124.69 90.75 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.48 ' HD2' ' OD1' ' A' ' 21' ' ' ASN . 57.2 Cg_endo -70.46 46.68 0.61 Allowed 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 123.246 2.631 . . . . 0.0 114.553 -172.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -127.54 -4.66 5.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.102 0.477 . . . . 0.0 109.89 173.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -92.93 131.46 33.34 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.085 -176.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -86.31 162.64 9.82 Favored 'Trans proline' 0 C--O 1.239 0.559 0 C-N-CA 122.813 2.342 . . . . 0.0 111.776 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.626 ' HB2' ' HB2' ' A' ' 48' ' ' PHE . 3.2 ttm180 -60.96 117.87 6.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.18 -6.29 7.23 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.113 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.587 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 28.0 m -74.92 112.82 11.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 176.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.523 ' CG ' HD22 ' A' ' 98' ' ' LEU . 34.5 p90 -125.68 161.34 27.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.987 0.422 . . . . 0.0 111.839 -174.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.2 pt? -159.99 138.2 10.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.401 171.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.45 HG13 ' HA ' ' A' ' 6' ' ' TYR . 0.1 OUTLIER -98.97 114.76 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.463 0.649 . . . . 0.0 110.585 178.771 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 29.9 ptt180 -108.22 149.28 28.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.465 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.591 ' HG2' ' CE2' ' A' ' 41' ' ' TYR . 33.1 mt-10 -87.22 126.13 34.62 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 t -74.72 115.9 14.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.179 0.514 . . . . 0.0 110.103 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.29 -17.08 63.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.786 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.1 m -78.85 -34.76 44.79 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.281 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.7 m -136.67 113.56 10.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.957 0.408 . . . . 0.0 110.928 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -70.51 121.72 18.33 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.033 0.444 . . . . 0.0 110.638 -178.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.668 ' HA3' ' HD2' ' A' ' 63' ' ' LYS . . . 102.05 -4.86 52.66 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.016 -178.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.42 113.3 26.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.082 0.468 . . . . 0.0 110.169 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.782 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 69.1 m-85 -102.4 141.32 35.41 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.598 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 56.7 m -103.2 103.91 14.0 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.654 ' HB3' ' HB2' ' A' ' 59' ' ' TYR . 2.4 tm? -79.67 86.9 5.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 172.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.2 m -84.81 114.78 22.33 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.001 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.92 136.55 50.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.938 0.399 . . . . 0.0 110.244 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.519 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 t -78.16 115.45 17.9 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.591 0.71 . . . . 0.0 109.2 172.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -110.25 136.85 48.8 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.445 -1.252 . . . . 0.0 108.982 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 26' ' ' ARG . 56.6 t80 -82.02 126.38 31.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.985 0.421 . . . . 0.0 110.4 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -117.54 146.66 43.42 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.3 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.27 -13.9 56.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.839 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.26 -41.19 3.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.815 0.341 . . . . 0.0 110.792 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -85.91 -24.51 26.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.94 -73.14 1.99 Allowed Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -175.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.08 132.7 49.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -132.4 140.38 48.44 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 60.2 t -92.71 109.29 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.25 0.548 . . . . 0.0 110.347 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.435 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 34.9 ttmt -92.26 105.21 17.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.74 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -86.6 107.93 18.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.063 -177.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.654 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 99.1 m-85 -86.11 121.79 29.21 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -83.49 109.77 17.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.615 0.721 . . . . 0.0 111.412 -177.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.782 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 72.0 mt -86.95 99.93 9.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.545 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -95.33 146.99 23.97 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.511 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.668 ' HD2' ' HA3' ' A' ' 39' ' ' GLY . 0.1 OUTLIER -92.74 139.08 30.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.244 0.545 . . . . 0.0 109.914 177.623 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.442 HD11 ' NE2' ' A' ' 76' ' ' GLN . 13.9 mt -84.17 159.5 21.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.768 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -74.85 74.3 2.12 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.842 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.8 m 81.82 26.93 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.893 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.11 -38.87 1.46 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.877 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 145.39 -139.1 8.08 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 121.236 -0.506 . . . . 0.0 111.917 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -129.08 145.94 51.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -150.92 139.33 20.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.173 0.511 . . . . 0.0 111.507 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.538 HD12 ' CE2' ' A' ' 87' ' ' TYR . 33.0 mt -89.04 -30.37 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.913 0.864 . . . . 0.0 108.965 170.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -136.88 144.97 43.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.067 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.6 p -66.53 -11.04 50.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.238 -173.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.1 ptm180 -85.64 -20.7 29.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.041 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 m -135.69 112.27 10.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 0.0 111.327 -174.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.442 ' NE2' HD11 ' A' ' 64' ' ' LEU . 62.8 mt-30 -115.55 143.93 44.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.668 -176.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.418 ' HZ ' ' CD2' ' A' ' 86' ' ' TYR . 94.7 m-85 -126.97 162.73 25.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.116 177.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 t -86.72 -29.98 22.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.852 -0.158 . . . . 0.0 111.305 -177.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 88.3 p -143.81 167.77 21.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.619 0.247 . . . . 0.0 110.703 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 83' ' ' LEU . 2.6 mm? -65.47 -26.4 67.92 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.8 0.333 . . . . 0.0 111.161 177.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.32 -43.16 91.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.429 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -70.1 -31.0 68.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 2.2 tm? -55.78 -68.23 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.699 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.96 -41.67 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -173.587 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.98 -27.89 47.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.039 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.418 ' CD2' ' HZ ' ' A' ' 77' ' ' PHE . 85.5 t80 -84.24 -52.39 6.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.85 178.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.538 ' CE2' HD12 ' A' ' 71' ' ' ILE . 22.5 m-85 -65.37 -15.91 63.06 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.629 -175.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.643 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.9 t -66.23 -32.02 73.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.007 0.432 . . . . 0.0 110.441 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.488 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 73.3 mmtt -113.59 -41.01 3.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.849 -176.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.534 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 13.1 m-70 -120.99 110.17 15.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -72.41 -39.25 68.07 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.98 -176.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 65.36 -75.52 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.628 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.79 -34.8 4.52 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.593 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -58.42 142.09 49.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.307 0.575 . . . . 0.0 111.238 176.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 20.7 m -74.45 -24.99 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.875 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -137.38 147.95 45.87 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.664 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 89' ' ' LYS . 40.3 mtm180 -84.71 135.77 34.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.037 -177.335 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 81.7 mt -55.8 110.35 0.71 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.905 0.384 . . . . 0.0 110.537 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -94.92 -63.25 1.19 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.386 -174.071 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -134.74 146.93 49.87 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.404 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.5 t -83.37 153.39 3.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.014 -178.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.3 t -59.28 136.52 88.56 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.668 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.7 Cg_exo -65.68 146.11 83.2 Favored 'Trans proline' 0 C--N 1.347 0.447 0 C-N-CA 123.012 2.474 . . . . 0.0 111.553 175.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 p -89.73 164.05 14.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.667 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 63.0 m 60.98 98.41 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.252 0.621 . . . . 0.0 112.278 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttm . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.33 -0.843 . . . . 0.0 109.999 177.64 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.671 0.272 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.34 62.73 0.55 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -91.58 -175.42 4.19 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.751 -172.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -57.27 -52.67 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.04 0.448 . . . . 0.0 110.434 174.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -71.61 -35.97 70.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.946 -177.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.437 ' HA ' HG13 ' A' ' 31' ' ' VAL . 39.3 t80 -89.41 101.06 13.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.889 0.376 . . . . 0.0 110.793 -176.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.476 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 15.5 m-85 -84.37 -33.62 23.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.369 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 124.83 -166.8 17.36 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.321 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.829 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 14.1 pttp -89.5 59.28 4.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.877 0.846 . . . . 0.0 111.229 -178.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.1 pt -76.42 149.21 6.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.671 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 47.2 p -82.35 167.75 18.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -61.84 -38.55 88.62 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.621 -177.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -41.29 68.6 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.232 0.539 . . . . 0.0 110.694 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -78.49 -47.59 17.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.491 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -61.35 -48.43 81.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.477 -176.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.62 -32.37 69.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.021 -176.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -60.05 -30.57 69.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.95 -40.39 28.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.095 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 30' ' ' LEU . 74.5 mt -81.96 -23.11 36.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.8 mm? -85.22 42.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.338 0.589 . . . . 0.0 111.261 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -104.62 128.78 26.19 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 169.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.665 ' HA ' HD11 ' A' ' 54' ' ' LEU . 11.9 Cg_endo -55.23 -22.15 31.43 Favored 'Trans proline' 0 N--CA 1.473 0.306 0 C-N-CA 123.495 2.797 . . . . 0.0 114.549 -170.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -98.74 23.75 8.39 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.852 -177.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 14.6 m-80 -78.17 115.46 51.03 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 120.853 0.359 . . . . 0.0 110.045 173.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 21.5 Cg_exo -65.35 154.32 74.16 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.907 2.405 . . . . 0.0 111.956 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -66.16 109.1 2.49 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.484 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.91 22.55 5.62 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.544 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 61.5 m -83.73 124.38 30.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 175.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.473 ' CG ' HD22 ' A' ' 98' ' ' LEU . 29.5 p90 -133.29 161.62 34.0 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.92 138.23 9.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.788 170.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.471 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.1 p -103.47 118.91 51.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.666 0.746 . . . . 0.0 110.855 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 19.0 ptt85 -112.67 148.81 33.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.443 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.829 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 35.0 tt0 -83.93 134.99 34.64 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 37' ' ' THR . 38.0 m -73.75 130.06 39.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.434 0.635 . . . . 0.0 111.565 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -79.36 -18.7 51.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.488 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.2 p -119.89 9.22 11.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 34' ' ' SER . 78.9 m -153.79 124.63 7.25 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.758 0.313 . . . . 0.0 110.653 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -103.64 138.87 39.7 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.789 0.328 . . . . 0.0 110.131 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.31 9.38 56.88 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -175.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -150.44 120.75 7.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.938 0.399 . . . . 0.0 110.392 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 57.0 m-85 -101.3 165.01 11.5 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.454 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 32.4 t -117.47 111.64 19.56 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.744 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.471 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.3 tm? -90.71 87.03 6.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.4 m -78.28 122.09 25.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.869 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 p -118.67 138.43 49.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.96 0.41 . . . . 0.0 110.331 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -94.19 128.96 40.93 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.604 0.716 . . . . 0.0 110.063 179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -112.16 133.23 54.42 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.519 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -105.97 112.52 25.61 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.457 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -118.59 147.74 43.4 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.469 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -79.58 -13.36 59.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.719 -174.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.21 -44.0 2.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 111.246 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -81.4 -20.59 40.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.064 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 85.94 -133.11 11.55 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.98 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.665 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.0 mt -96.84 109.65 22.31 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.146 0.498 . . . . 0.0 110.284 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -105.87 116.52 32.08 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.009 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 82.7 t -91.62 107.8 19.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.151 0.5 . . . . 0.0 109.937 178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -95.31 114.52 26.31 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.216 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -89.56 87.11 6.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.537 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.449 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 76.8 m-85 -76.46 157.38 32.25 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -123.04 120.6 33.81 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.22 0.533 . . . . 0.0 111.51 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.615 HG12 HG12 ' A' ' 71' ' ' ILE . 52.8 mt -89.8 88.24 2.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.782 176.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -93.71 154.46 17.78 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.504 -174.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 21.4 pttp -109.8 142.6 40.83 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.105 0.479 . . . . 0.0 110.214 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.483 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 45.2 mt -78.97 175.01 10.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.801 177.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -62.06 -46.27 89.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.705 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.9 t -153.28 58.71 0.77 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -140.59 -33.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.839 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 121.73 -158.97 16.41 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.248 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.67 147.84 25.54 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.448 0.299 . . . . 0.0 110.389 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.483 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 44.9 p90 -156.04 143.23 19.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.602 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.705 HG21 HD11 ' A' ' 94' ' ' LEU . 62.0 mt -83.86 -29.78 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.578 0.704 . . . . 0.0 109.134 173.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.459 HG21 ' HA3' ' A' ' 93' ' ' GLY . 11.5 t -146.12 161.06 41.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.472 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.8 p -78.07 59.34 2.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.986 0.422 . . . . 0.0 111.304 -177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -132.04 -78.98 0.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.37 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.8 m -100.67 122.42 43.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.335 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -104.17 147.11 27.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.262 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.587 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 95.9 m-85 -132.02 142.25 49.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 121.343 0.592 . . . . 0.0 111.391 -178.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -72.67 -21.3 61.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.517 -177.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.1 p -141.34 172.66 12.37 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.82 0.343 . . . . 0.0 111.231 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 85.7 mt -79.52 -28.19 41.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.712 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -64.9 -43.7 92.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 77' ' ' PHE . 76.7 mt-30 -60.76 -36.76 79.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.393 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 71' ' ' ILE . 3.2 tm? -55.75 -67.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.564 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.415 ' H ' HG22 ' A' ' 84' ' ' VAL . 0.2 OUTLIER -62.9 -41.47 92.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -175.434 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.94 -34.92 66.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.79 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.976 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.764 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 34.9 m-85 -70.93 -7.75 48.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.373 -176.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.585 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.9 t -71.31 -23.04 61.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.188 0.518 . . . . 0.0 110.08 173.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -116.05 -45.75 2.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.177 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.764 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 24.9 m-70 -111.06 116.67 31.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.049 177.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.58 -24.51 64.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.529 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 35.3 t70 62.63 -81.8 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.612 0.765 . . . . 0.0 112.072 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -101.53 -33.26 4.85 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.743 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.705 HD11 HG21 ' A' ' 71' ' ' ILE . 4.0 mp -71.0 171.05 11.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.052 0.453 . . . . 0.0 110.329 175.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' CYS . . . . . 0.437 ' HG ' ' CE1' ' A' ' 96' ' ' HIS . 5.5 p -114.3 12.74 17.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.455 0.645 . . . . 0.0 109.514 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 95' ' ' CYS . 79.2 m80 -128.26 118.15 22.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.001 -0.999 . . . . 0.0 109.756 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 97' ' ' ARG . 33.5 mtt180 -75.66 133.6 40.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 64.8 mt -66.49 88.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.4 m -88.49 -57.5 2.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.439 -171.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.5 p-10 -130.64 145.2 51.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.824 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.88 158.4 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.842 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.3 t -56.4 133.64 76.48 Favored Pre-proline 0 C--N 1.327 -0.396 0 O-C-N 123.498 0.499 . . . . 0.0 111.292 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.34 154.56 56.17 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.697 2.265 . . . . 0.0 112.019 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.1 p -94.8 165.48 12.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.513 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.3 t -95.77 119.83 34.96 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -177.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.418 ' HB3' ' HE2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.751 -0.642 . . . . 0.0 110.026 -178.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.4 tm0? . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 120.896 0.379 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.27 135.42 14.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.059 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -68.62 146.62 52.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.299 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.04 -50.11 28.96 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 123.62 0.575 . . . . 0.0 112.101 -172.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.491 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 4.6 p-90 -77.94 -31.23 50.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.358 -174.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.491 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 63.4 t80 -91.11 106.33 18.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.789 0.328 . . . . 0.0 111.082 -174.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 43.8 m-85 -94.55 15.32 18.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.511 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 81.79 -131.09 10.14 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.552 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -122.54 115.73 22.68 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.671 0.748 . . . . 0.0 110.033 176.59 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 14' ' ' GLU . 35.1 pt -131.85 154.08 39.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.045 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.7 p -96.9 179.85 4.81 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.549 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 12' ' ' ARG . 8.2 ptm180 -54.51 -32.04 57.3 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.191 0.307 . . . . 0.0 111.232 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 59.9 ttp180 -59.72 -51.79 68.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.902 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.566 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 11.8 mp0 -72.68 -45.81 57.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.934 0.397 . . . . 0.0 110.458 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.9 t -59.73 -66.87 0.45 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.959 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.06 -23.1 65.2 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -177.495 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -62.66 -42.44 99.62 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.2 0.524 . . . . 0.0 109.963 178.523 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.8 mt -80.89 -39.57 26.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.878 -177.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 30' ' ' LEU . 62.4 mt -79.45 -35.22 40.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.267 -172.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 3.9 mm? -83.21 14.18 3.68 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.177 0.513 . . . . 0.0 110.524 177.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -92.82 107.19 22.61 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 172.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -72.63 49.17 1.44 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.327 2.685 . . . . 0.0 114.416 -169.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -119.63 4.72 11.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.345 0.593 . . . . 0.0 109.839 172.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -104.59 144.25 28.33 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.339 -178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -84.61 168.7 11.11 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 123.156 2.571 . . . . 0.0 112.054 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -63.96 129.23 39.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.949 0.404 . . . . 0.0 110.834 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.19 3.67 31.24 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.213 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.508 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 85.4 m -72.33 109.15 5.86 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.902 -0.406 . . . . 0.0 109.902 175.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.472 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.5 p90 -126.83 161.31 28.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 111.621 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.59 143.64 13.26 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.41 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -107.78 122.13 61.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.69 0.757 . . . . 0.0 110.905 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.44 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 16.1 ptt180 -117.19 142.07 47.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.228 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -81.92 121.5 26.57 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.807 ' HB2' HG22 ' A' ' 37' ' ' THR . 4.2 m -77.54 113.15 15.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.686 0.279 . . . . 0.0 110.304 -177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -70.54 -3.83 19.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.862 0.363 . . . . 0.0 111.477 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.7 t -95.63 9.19 41.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.139 0.495 . . . . 0.0 110.7 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.96 HG21 ' HB3' ' A' ' 40' ' ' ALA . 11.1 t -150.14 169.78 20.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.734 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -123.67 30.08 6.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.558 0.694 . . . . 0.0 110.736 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.459 ' HA2' ' HE2' ' A' ' 63' ' ' LYS . . . 171.2 44.18 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.801 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.96 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -152.34 101.44 2.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.146 0.498 . . . . 0.0 110.614 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 41.9 m-85 -90.71 149.37 22.08 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.82 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.0 m -108.92 106.48 16.48 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.694 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.475 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -84.41 88.2 7.27 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m -85.5 108.75 18.07 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.357 -176.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.2 p -107.89 124.56 64.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.336 0.589 . . . . 0.0 110.653 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.6 t -79.39 129.81 34.82 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.138 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.34 115.65 13.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.136 -176.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -83.45 83.97 7.69 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 170.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -71.21 110.31 5.78 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.03 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -74.19 73.65 1.77 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.203 0.525 . . . . 0.0 110.552 -172.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.82 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.938 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -121.93 -34.57 3.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.709 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.77 -148.45 16.86 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.648 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -75.51 114.93 14.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.0 111.67 -177.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -126.13 117.39 23.04 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 91.9 t -88.93 106.2 16.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -84.23 102.26 12.5 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.12 -175.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 32' ' ' ARG . 15.2 m-70 -80.98 93.89 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.914 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.691 ' HB3' HG23 ' A' ' 71' ' ' ILE . 57.4 m-85 -77.13 124.62 28.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.119 0.485 . . . . 0.0 110.025 177.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -88.23 110.9 21.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.07 -170.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.718 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 54.4 mt -91.45 94.25 4.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.793 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.2 ttp180 -92.01 157.07 16.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.745 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' ' HA2' ' A' ' 39' ' ' GLY . 43.5 mtmt -97.88 147.23 24.65 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.624 0.726 . . . . 0.0 112.168 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.477 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 87.1 mt -115.84 130.55 56.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.332 -1.303 . . . . 0.0 109.212 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -72.54 -22.6 60.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.938 0.399 . . . . 0.0 110.482 -178.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 p -113.89 30.97 6.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.789 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.41 -94.08 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.325 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.477 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 173.52 -134.01 2.77 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.828 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -99.26 137.02 38.36 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' A' ' 61' ' ' ILE . 25.8 p90 -144.11 140.46 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.167 0.508 . . . . 0.0 110.839 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 59.2 mt -87.0 -35.37 8.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.781 174.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.2 t -143.63 159.75 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.452 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -75.88 57.28 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.507 0.67 . . . . 0.0 110.739 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -130.74 -64.45 0.83 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.773 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.2 m -134.47 123.01 23.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.698 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -115.29 144.06 44.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.679 0.276 . . . . 0.0 110.831 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -127.62 147.3 50.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 p -83.35 10.5 8.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.126 0.489 . . . . 0.0 111.125 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLN . 30.0 m -148.65 135.23 19.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.773 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.634 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.9 mt -63.25 -35.2 79.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.647 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -61.73 -46.06 91.26 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.713 0.292 . . . . 0.0 110.819 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.405 ' HG2' ' HB2' ' A' ' 79' ' ' SER . 13.9 mm100 -61.34 -38.63 87.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.821 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -58.42 -64.14 1.03 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.994 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.9 m -63.51 -45.31 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.61 -33.64 68.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -78.12 -46.3 21.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.832 0.349 . . . . 0.0 110.462 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-85 -73.11 -7.33 50.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.442 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.601 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 28.0 t -74.67 -15.92 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.281 0.562 . . . . 0.0 109.851 174.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -120.58 -51.42 2.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.626 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.0 t-80 -103.4 107.06 17.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.76 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 66.92 -65.48 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.071 0.548 . . . . 0.0 112.458 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -125.6 -30.93 0.86 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.952 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.581 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.3 mp -64.92 148.28 51.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.281 0.562 . . . . 0.0 111.183 178.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 62.2 m -78.4 -6.97 56.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.933 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -152.71 144.33 23.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -67.62 145.62 54.67 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.91 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 87.5 mt -64.79 95.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.7 m -90.34 -60.5 1.91 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.754 -171.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.8 p-10 -131.66 141.19 49.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -176.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -80.87 149.95 4.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.7 t -56.7 117.95 20.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 2.7 Cg_exo -75.18 147.37 33.17 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.912 2.408 . . . . 0.0 110.712 173.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 t -159.44 169.46 23.87 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.167 0.508 . . . . 0.0 110.793 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.2 t -166.72 155.16 10.22 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.539 ' NZ ' ' HB2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.133 -177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.753 0.311 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.534 ' O ' ' HB3' ' A' ' 6' ' ' TYR . . . -126.53 108.39 11.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.18 179.35 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 58.75 -170.0 0.12 Allowed 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.6 0.563 . . . . 0.0 111.821 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -98.89 -54.99 2.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.273 0.558 . . . . 0.0 110.063 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.436 ' HE3' ' CG1' ' A' ' 31' ' ' VAL . 5.3 p-90 -68.6 -28.73 67.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.854 -176.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.534 ' HB3' ' O ' ' A' ' 2' ' ' ALA . 23.9 t80 -80.89 125.93 30.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.199 -178.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 16.9 m-85 -118.62 34.6 5.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.043 0.449 . . . . 0.0 111.9 -178.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.5 -141.52 35.43 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.934 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 33.0 mtmm -117.98 48.34 1.41 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.74 0.305 . . . . 0.0 111.22 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 pt -67.81 151.32 10.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.56 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.3 p -80.62 172.46 13.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.203 -178.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -59.77 -48.22 82.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 110.283 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.8 -47.5 77.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.137 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.2 -41.13 97.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.931 0.396 . . . . 0.0 110.826 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 22.7 t -62.95 -48.15 80.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.283 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HB3' HD23 ' A' ' 20' ' ' LEU . 61.3 mt-10 -69.74 -27.91 65.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.357 -178.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -60.74 -30.19 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.224 0.535 . . . . 0.0 110.374 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.14 -28.49 18.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.469 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.563 HD21 HD22 ' A' ' 30' ' ' LEU . 83.3 mt -93.83 -34.23 13.24 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.1 mm? -79.17 49.43 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.481 0.658 . . . . 0.0 111.179 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -125.23 112.81 26.18 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.82 41.76 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.998 2.465 . . . . 0.0 113.326 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -128.45 9.44 6.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.931 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -110.5 149.88 40.87 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.681 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -82.92 157.68 15.62 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.81 2.34 . . . . 0.0 112.158 176.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -62.94 140.07 58.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 120.898 0.38 . . . . 0.0 110.396 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.97 2.43 59.43 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.39 -0.909 . . . . 0.0 111.667 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.712 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 65.3 m -73.2 110.79 7.76 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.583 ' CG ' HD22 ' A' ' 98' ' ' LEU . 27.0 p90 -127.35 158.07 38.24 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.124 0.487 . . . . 0.0 111.586 -172.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.588 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.6 pt? -152.24 132.86 13.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.504 170.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 5' ' ' TRP . 2.6 p -103.1 114.27 42.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.964 -177.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 24.4 ptt85 -109.1 144.16 37.5 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.07 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.685 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 36.6 tt0 -83.36 138.21 33.62 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.131 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 45.4 t -88.01 138.15 31.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.336 0.589 . . . . 0.0 111.686 -175.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -93.34 -15.85 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.307 175.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.3 p -98.96 -5.56 30.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -173.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.447 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 17.6 m -148.69 131.63 16.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.714 0.292 . . . . 0.0 110.734 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.98 121.33 26.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.47 -178.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.72 31.23 36.87 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.143 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -130.45 128.84 42.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.92 0.39 . . . . 0.0 110.241 178.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -119.86 147.67 44.41 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.81 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 35.4 m -105.15 94.75 5.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.529 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.7 tm? -77.93 88.86 4.1 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 174.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.6 m -87.27 114.84 24.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.488 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -120.25 141.2 41.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.086 0.469 . . . . 0.0 111.124 -176.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.0 t -84.15 129.36 34.9 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.801 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 25.5 t0 -123.61 61.12 1.07 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.435 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.71 111.44 3.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.381 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 52' ' ' LYS . 9.9 t70 -114.97 144.12 44.09 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.448 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -75.06 -12.44 60.32 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.927 -170.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -104.27 -44.22 5.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.856 0.36 . . . . 0.0 111.304 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.515 ' HG2' ' OD2' ' A' ' 49' ' ' ASP . 6.6 ptpp? -101.19 -9.0 21.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.19 0.519 . . . . 0.0 111.575 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.49 -148.71 19.73 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.544 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 86.0 mt -80.73 114.6 19.73 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.41 0.284 . . . . 0.0 111.129 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.547 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 9.7 m120 -115.13 124.05 50.52 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.622 HG21 HD22 ' A' ' 20' ' ' LEU . 79.8 t -111.59 114.66 47.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.211 0.529 . . . . 0.0 110.373 177.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -97.81 105.59 17.76 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.106 -176.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -81.61 83.9 6.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -67.34 127.07 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.29 0.567 . . . . 0.0 111.864 -176.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -82.04 96.1 7.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.485 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.704 HD11 ' HB2' ' A' ' 43' ' ' LEU . 58.6 mt -74.92 97.72 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 175.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -91.4 137.8 32.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.383 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' PHE . 51.2 pttt -91.83 151.57 20.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.253 0.549 . . . . 0.0 109.983 174.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.43 157.51 20.46 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 168.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -51.32 -44.08 61.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.3 m -67.51 -26.84 66.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 123.02 42.74 0.39 Allowed Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.37 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.61 108.66 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.917 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 63' ' ' LYS . 84.7 m-85 -84.97 130.13 34.68 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -143.12 143.25 31.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.394 0.616 . . . . 0.0 111.306 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 70.8 mt -92.4 -39.44 11.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.469 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.8 t -114.78 147.89 39.15 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.813 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.0 p -67.81 -7.24 26.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 74' ' ' ARG . 63.7 mtt180 -83.74 -57.61 3.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.904 0.383 . . . . 0.0 110.812 178.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 86' ' ' TYR . 1.3 m -101.68 104.82 15.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.812 -171.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -113.96 133.87 55.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.668 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 83' ' ' LEU . 83.8 m-85 -124.49 146.6 48.87 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.2 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.4 t -88.23 -2.39 58.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 45.5 m -144.03 137.35 27.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.054 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.538 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.9 mt -65.38 -23.46 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -56.52 -47.72 78.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.297 0.57 . . . . 0.0 110.204 174.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -73.36 -27.2 61.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.638 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 3.4 tm? -59.12 -64.74 0.83 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.262 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.25 -44.31 97.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.755 -176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.76 -42.27 62.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.032 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.415 ' CD2' HG21 ' A' ' 75' ' ' THR . 91.2 t80 -78.14 -43.05 29.91 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.641 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -69.84 -12.34 61.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.665 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.475 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 50.0 m -72.63 -22.36 60.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.274 0.559 . . . . 0.0 110.096 173.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -104.59 -44.47 4.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.643 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.641 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 31.6 m-70 -125.5 114.81 19.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -76.39 -40.71 50.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.69 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.469 ' HB3' HG21 ' A' ' 72' ' ' THR . 12.2 t70 65.42 -76.32 0.04 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.732 177.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.03 -40.42 8.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.209 -0.52 . . . . 0.0 112.156 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.649 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.5 mp -67.4 150.15 49.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.061 0.457 . . . . 0.0 110.47 178.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 32.6 t -72.68 -18.03 61.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.558 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -149.79 139.68 21.89 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.625 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 32.7 ptt85 -73.58 158.18 35.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.093 0.473 . . . . 0.0 111.515 -176.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.583 HD22 ' CG ' ' A' ' 29' ' ' PHE . 59.6 mt -66.52 101.3 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.062 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.8 m -97.65 -41.5 8.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.636 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.712 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.0 t30 -141.65 132.74 26.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.026 0.441 . . . . 0.0 110.511 -175.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.4 t -81.06 139.39 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.458 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.0 t -53.65 118.76 15.82 Favored Pre-proline 0 C--N 1.33 -0.251 0 O-C-N 123.507 0.504 . . . . 0.0 111.135 -176.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.73 151.96 46.98 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.469 2.113 . . . . 0.0 111.558 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 t -73.61 144.51 45.94 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.943 0.401 . . . . 0.0 110.07 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.1 t -142.5 121.08 12.51 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.095 -171.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 C--O 1.244 0.797 0 CA-C-O 118.637 -0.697 . . . . 0.0 109.758 174.758 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.1 157.63 11.53 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.917 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -80.15 160.35 25.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.43 -28.51 13.18 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.538 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.79 ' HA ' HG11 ' A' ' 101' ' ' VAL . 15.3 p-90 -82.03 -28.72 32.35 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -99.59 110.15 22.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.118 0.485 . . . . 0.0 110.612 -174.668 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -98.94 -0.9 41.27 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.0 -156.6 23.75 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.193 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -86.47 61.35 6.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.396 0.617 . . . . 0.0 111.547 -177.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.557 HD11 HD13 ' A' ' 30' ' ' LEU . 46.3 pt -74.47 138.0 21.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 174.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.6 p -72.94 159.73 33.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 15' ' ' SER . 10.2 ptm180 -67.2 -23.54 65.75 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.883 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 23.2 tpt180 -61.89 -39.0 90.43 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.96 -35.42 64.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.791 176.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.523 ' HB3' ' HA ' ' A' ' 12' ' ' ARG . 29.0 t -60.52 -67.21 0.42 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.981 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.437 ' OE2' ' HB2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -54.48 -38.85 66.9 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.739 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -57.15 -39.46 75.27 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -177.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.0 mt -86.6 -34.89 19.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.6 mt -81.07 -17.96 48.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.215 -174.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.54 14.08 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.591 0.234 . . . . 0.0 111.567 177.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.571 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 21.5 t30 -67.77 120.14 71.45 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -57.35 -20.78 41.35 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.043 2.495 . . . . 0.0 113.302 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -98.47 21.1 11.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.858 0.361 . . . . 0.0 111.472 -178.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.571 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 94.5 m-20 -89.82 118.21 68.76 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 170.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.91 144.3 64.02 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.152 1.901 . . . . 0.0 111.489 175.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.45 ' HB2' ' HB3' ' A' ' 48' ' ' PHE . 41.0 ttp180 -56.41 110.68 0.81 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.109 177.349 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.16 -0.6 7.08 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.644 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 37.1 m -77.36 129.05 35.31 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 28.6 p90 -139.39 171.25 14.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.151 0.5 . . . . 0.0 111.959 -173.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.557 HD13 HD11 ' A' ' 10' ' ' ILE . 3.4 pp -158.17 149.2 20.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.513 166.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.6 p -108.07 120.65 59.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.746 0.784 . . . . 0.0 110.814 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.687 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.8 145.95 37.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.279 -179.324 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -89.63 131.89 35.4 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.319 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.8 t -104.64 107.71 18.79 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -75.66 -3.04 32.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.965 0.412 . . . . 0.0 111.315 -173.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -42.64 87.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.33 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 29.6 m -121.19 127.55 51.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.356 -177.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -79.12 74.26 5.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.419 0.628 . . . . 0.0 110.366 -177.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.554 ' HA2' ' HE3' ' A' ' 63' ' ' LYS . . . 139.52 27.08 0.25 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.202 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -138.86 97.65 3.37 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.174 0.511 . . . . 0.0 110.457 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.774 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.7 m-85 -90.7 169.81 10.67 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.687 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -128.55 110.56 12.38 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.6 tm? -89.68 93.52 9.5 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 175.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 38.0 m -84.49 105.42 15.29 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -104.4 135.03 44.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 t -75.89 125.59 29.39 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.534 0.683 . . . . 0.0 110.467 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -105.94 133.04 51.29 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.173 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.523 ' HA ' ' O ' ' A' ' 53' ' ' GLY . 55.7 t80 -141.73 114.6 8.57 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.761 0.791 . . . . 0.0 112.679 -171.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.888 ' HB3' ' HA3' ' A' ' 53' ' ' GLY . 0.6 OUTLIER -84.75 142.31 29.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.862 165.341 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -58.91 -12.73 4.84 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -166.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -129.02 -54.32 1.2 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -117.85 -11.18 10.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -166.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.888 ' HA3' ' HB3' ' A' ' 49' ' ' ASP . . . -102.42 58.26 0.59 Allowed Glycine 0 C--O 1.225 -0.411 0 C-N-CA 119.807 -1.187 . . . . 0.0 115.394 -163.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 12.5 mt -90.47 131.4 36.24 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.932 0.866 . . . . 0.0 110.538 171.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -175.85 166.89 3.1 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.8 t -102.92 125.24 57.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 120.773 0.321 . . . . 0.0 110.176 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -99.22 101.44 12.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -82.19 104.06 12.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.334 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.401 ' HB3' HG23 ' A' ' 71' ' ' ILE . 54.2 m-85 -91.37 136.68 32.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.872 173.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -93.51 127.49 39.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.182 0.515 . . . . 0.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.774 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.6 mt -93.5 101.41 12.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.259 177.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.2 142.79 27.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.831 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HE3' ' HA2' ' A' ' 39' ' ' GLY . 26.0 ttpp -108.75 128.57 54.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.614 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.8 mt -75.81 150.69 37.65 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.876 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -53.06 -54.7 31.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.053 0.454 . . . . 0.0 111.406 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -129.87 45.69 2.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.208 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 -107.21 0.74 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.202 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -152.83 -151.11 5.59 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.778 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -110.15 141.82 42.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.769 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 46.4 p90 -147.38 137.59 23.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.161 0.505 . . . . 0.0 110.923 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.503 HG12 HG12 ' A' ' 61' ' ' ILE . 75.2 mt -84.65 -52.56 12.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -103.81 146.8 28.1 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.545 171.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.5 t -81.74 47.91 1.14 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.238 0.542 . . . . 0.0 111.02 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 73.3 mtp180 -135.37 -57.73 0.79 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.918 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 31.0 m -105.23 116.79 32.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.769 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 8.4 pt20 -133.73 148.51 51.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.259 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.52 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 96.1 m-85 -131.79 143.38 50.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.161 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.5 m -75.56 -5.1 43.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.5 m -140.88 144.12 35.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.248 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 84' ' ' VAL . 69.6 mt -68.26 -27.27 66.19 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.112 -176.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -54.28 48.9 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -59.38 -33.33 71.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.309 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' C ' ' A' ' 83' ' ' LEU . 3.4 tm? -58.51 -65.24 0.69 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.47 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.83 -44.92 96.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -175.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.32 -43.65 83.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.033 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -76.26 -36.18 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.416 -177.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 8.4 m-85 -79.88 0.18 32.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.92 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 50.2 m -67.64 -29.74 69.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.48 0.657 . . . . 0.0 109.47 173.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -115.72 -43.22 3.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.984 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.566 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 73.1 m80 -94.97 90.88 6.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.308 -178.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.704 ' HB2' ' HG3' ' A' ' 97' ' ' ARG . . . -66.12 -35.57 80.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.884 0.373 . . . . 0.0 110.195 177.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.86 -83.99 0.02 OUTLIER 'General case' 0 C--O 1.235 0.292 0 CA-C-N 114.788 -1.097 . . . . 0.0 111.908 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.24 -42.75 4.84 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.993 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.67 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -60.81 153.02 25.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.056 0.455 . . . . 0.0 110.964 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 25.3 p -88.13 -10.07 51.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.161 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -121.65 149.99 42.39 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.661 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.704 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -105.84 137.6 43.45 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.093 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.8 mt -68.62 87.17 0.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.175 0.512 . . . . 0.0 110.706 -177.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.7 m -80.41 -48.58 12.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.548 -173.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.502 ' O ' ' HA ' ' A' ' 28' ' ' THR . 15.0 p-10 -155.24 152.71 29.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.791 0.329 . . . . 0.0 110.26 -178.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.79 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -91.52 140.35 16.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.996 -176.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.94 125.49 92.01 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.275 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.99 159.27 44.95 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.796 2.331 . . . . 0.0 111.683 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p -63.02 -20.65 65.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.913 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 10.6 m 62.14 83.84 0.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.26 0.553 . . . . 0.0 110.519 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.337 -0.84 . . . . 0.0 110.395 -175.706 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.91 0.386 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.72 172.06 13.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 175.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.16 118.3 5.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.4 0.619 . . . . 0.0 109.727 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -54.9 -43.98 73.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.613 -168.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -76.56 -38.49 54.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.409 ' HA ' HG13 ' A' ' 31' ' ' VAL . 37.0 t80 -86.34 107.21 17.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 0.0 111.053 -173.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.487 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 27.1 m-85 -97.88 14.41 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.361 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.02 -143.42 28.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.763 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -111.17 51.6 0.77 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.138 0.494 . . . . 0.0 111.26 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 pt -61.73 147.17 11.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.057 175.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.7 p -87.82 -175.96 5.33 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.587 -177.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -39.51 94.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.97 0.414 . . . . 0.0 110.7 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -55.07 -48.22 73.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.321 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.66 -55.31 15.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.552 -176.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.9 p -61.36 -56.76 16.74 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -172.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HB3' HD23 ' A' ' 20' ' ' LEU . 1.6 mp0 -66.62 -29.25 69.24 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -176.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -66.46 -25.26 66.64 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.935 -0.478 . . . . 0.0 110.481 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.7 mt -85.52 -38.75 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.97 0.414 . . . . 0.0 110.794 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.42 HD11 HD21 ' A' ' 30' ' ' LEU . 81.7 mt -82.06 -28.67 32.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.162 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 20' ' ' LEU . 4.0 mm? -78.89 52.35 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.997 0.427 . . . . 0.0 111.442 178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 51.3 m-80 -136.33 132.02 18.78 Favored Pre-proline 0 C--N 1.32 -0.713 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 15.3 Cg_exo -69.41 7.67 0.85 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.303 2.669 . . . . 0.0 112.4 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -94.36 -1.0 54.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.053 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -97.21 129.18 32.73 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.09 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.516 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 15.2 Cg_exo -66.24 138.68 52.21 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.279 1.986 . . . . 0.0 111.087 173.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HD3' ' H ' ' A' ' 48' ' ' PHE . 45.7 ttp180 -61.79 101.31 0.19 Allowed 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.85 -3.12 3.42 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.505 -171.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 89.1 m -69.77 117.47 11.41 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 122.452 0.301 . . . . 0.0 110.457 175.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 36.5 p90 -123.98 164.68 18.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.067 0.46 . . . . 0.0 111.821 -175.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.9 pt? -164.22 146.02 8.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.709 173.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.544 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -112.94 120.18 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.52 0.676 . . . . 0.0 111.347 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.536 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 27.4 ptt180 -107.17 150.98 26.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.169 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -92.45 142.59 27.26 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 175.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.2 t -72.36 123.54 23.26 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -76.88 -15.25 59.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.909 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -101.09 -21.78 14.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.906 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 23.8 m -130.23 121.0 25.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.059 0.457 . . . . 0.0 111.479 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -85.25 115.4 23.0 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 1.034 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 115.1 11.74 10.61 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.603 -175.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.03 129.16 23.68 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.006 0.431 . . . . 0.0 110.493 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.777 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 88.4 m-85 -120.25 179.67 4.22 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.536 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 61.5 m -139.09 100.11 3.94 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.688 0.28 . . . . 0.0 110.332 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.8 tm? -82.94 95.96 8.15 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 174.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.5 t -93.19 143.09 26.59 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.91 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.8 p -136.05 133.01 50.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.155 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -80.14 126.61 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.592 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.4 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 5.5 t70 -128.52 147.59 50.7 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.792 -178.546 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.453 ' H ' ' HD3' ' A' ' 26' ' ' ARG . 87.8 t80 -133.34 113.66 12.84 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.335 0.588 . . . . 0.0 110.698 178.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.537 ' HB3' ' HD3' ' A' ' 52' ' ' LYS . 11.6 m-20 -105.8 137.99 42.75 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.84 173.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -71.4 -9.13 57.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.353 -173.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.17 -21.59 9.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.537 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -103.2 -23.8 13.6 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.858 0.361 . . . . 0.0 111.315 -177.106 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.05 23.09 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.69 114.79 17.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.928 0.394 . . . . 0.0 110.489 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -108.72 120.18 41.73 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.058 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 74.2 t -92.04 107.09 18.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.035 0.445 . . . . 0.0 109.971 175.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -91.51 100.38 13.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.944 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -85.56 88.99 7.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.491 . . . . 0.0 110.471 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.589 ' HB3' HG23 ' A' ' 71' ' ' ILE . 87.7 m-85 -77.79 88.04 4.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.542 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 42' ' ' CYS . 22.2 pttp -62.75 132.26 51.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.231 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.777 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 70.5 mt -98.8 125.9 52.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.499 -176.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -109.27 137.52 47.03 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.333 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 1.034 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 23.1 mtpp -84.71 145.21 28.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.502 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.99 -6.69 48.92 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 168.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.498 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 10.2 t70 73.93 -55.57 0.66 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.649 178.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.0 m -105.94 24.98 11.49 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.949 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.62 -107.82 0.46 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.291 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -129.42 -157.04 9.04 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.205 -174.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -119.38 141.75 48.79 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -146.07 136.05 23.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.507 0.67 . . . . 0.0 111.6 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.756 HG12 HG12 ' A' ' 61' ' ' ILE . 69.9 mt -82.77 -48.3 17.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.13 173.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -118.53 150.78 39.05 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.904 176.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -81.1 51.53 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -135.96 -77.53 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.326 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.0 m -94.47 104.47 16.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.209 0.528 . . . . 0.0 110.01 178.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -110.7 150.21 29.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 -173.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -129.51 141.55 50.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.977 0.417 . . . . 0.0 110.916 -178.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.521 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 15.8 m -83.1 20.46 1.23 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.686 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.9 t -167.57 161.45 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.548 ' O ' HG22 ' A' ' 84' ' ' VAL . 58.5 mt -83.48 -34.38 25.39 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -171.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -43.62 80.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -57.39 -36.33 71.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.414 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -61.81 -62.48 1.77 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.65 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -63.61 -43.21 98.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.157 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.04 -45.13 79.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.75 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -75.24 -42.61 54.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.776 0.322 . . . . 0.0 110.994 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-30 -70.16 -4.15 20.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.509 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -29.39 65.76 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.332 0.587 . . . . 0.0 109.725 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -107.11 -48.02 3.56 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.704 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.628 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.9 m-70 -107.24 102.41 11.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.276 -179.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -68.42 -37.08 79.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.814 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 t70 68.39 -71.63 0.11 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.69 175.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.44 -39.23 3.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.127 -0.558 . . . . 0.0 111.86 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.658 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -63.04 146.54 53.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.876 0.369 . . . . 0.0 110.68 176.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.1 -15.6 56.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.335 177.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -133.42 135.31 44.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.661 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -85.1 152.41 23.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.034 0.445 . . . . 0.0 110.63 -179.179 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 56.6 mt -67.56 101.83 1.06 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.959 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.2 m -91.58 -62.84 1.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.2 p-10 -133.67 147.92 51.45 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -177.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.537 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.3 t -91.13 151.75 3.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.251 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 52.4 t -57.97 124.71 70.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.016 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 9.2 Cg_endo -89.76 178.14 2.44 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 123.39 2.726 . . . . 0.0 112.277 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.4 p -110.42 132.72 53.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.434 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 45.2 t 64.18 61.07 0.93 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.479 0.487 . . . . 0.0 110.853 -175.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.357 177.846 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 121.47 0.653 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.02 144.92 0.46 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.052 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.499 ' HB2' ' CB ' ' A' ' 6' ' ' TYR . 5.9 mm-40 -69.55 137.46 52.44 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.451 ' O ' HG11 ' A' ' 101' ' ' VAL . 28.5 mm-40 -55.0 -29.69 57.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.504 -172.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.408 ' HE3' HG11 ' A' ' 31' ' ' VAL . 9.0 p-90 -96.14 -33.94 11.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CB ' ' HB2' ' A' ' 3' ' ' GLU . 9.8 t80 -79.54 93.64 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.796 -174.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.448 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.9 m-85 -80.74 -21.48 41.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.115 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.57 -158.05 27.11 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.596 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.578 ' HG2' ' HB2' ' A' ' 33' ' ' GLU . 66.5 mttm -79.26 55.14 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.6 pt -78.18 153.69 5.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -83.96 154.14 23.5 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.785 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 13' ' ' ARG . 17.8 ptt85 -56.94 -40.07 75.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -170.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.432 ' N ' ' HG3' ' A' ' 12' ' ' ARG . 22.3 tpp180 -60.54 -35.01 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.63 0.253 . . . . 0.0 110.72 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 46.7 mt-10 -65.56 -40.25 92.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.229 177.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.6 m -66.58 -47.6 72.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.269 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.24 -40.17 96.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.639 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -57.64 -31.99 66.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.277 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 92.0 mt -84.86 -39.66 18.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.397 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 30' ' ' LEU . 60.2 mt -80.77 -27.93 36.58 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.481 HD12 HD13 ' A' ' 54' ' ' LEU . 3.8 mm? -79.83 50.71 1.21 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.669 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -135.99 139.23 29.75 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.49 14.41 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.202 2.601 . . . . 0.0 112.843 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -97.32 -1.74 43.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.44 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 41.2 m-80 -110.34 112.76 56.84 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.358 -177.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 30.2 Cg_endo -65.36 157.0 60.27 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.53 2.153 . . . . 0.0 111.432 175.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -63.13 99.76 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.98 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 138.32 -0.66 2.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.072 -174.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 59.7 m -72.38 124.68 25.64 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 31.7 p90 -132.15 166.07 22.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.14 0.495 . . . . 0.0 112.127 -173.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.516 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -160.3 143.51 13.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.713 170.342 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.454 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.1 p -107.12 115.44 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.636 0.731 . . . . 0.0 111.171 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 1.6 ptm180 -104.05 157.4 17.14 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.812 177.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.578 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 49.5 mt-10 -96.31 137.68 35.03 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 174.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -82.81 118.11 23.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.604 0.716 . . . . 0.0 109.398 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -62.57 -40.18 96.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.996 -178.741 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -84.98 -65.87 0.96 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.323 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.2 m -77.68 92.09 4.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.439 0.637 . . . . 0.0 110.567 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -82.32 151.98 26.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.756 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.462 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 82.67 14.43 75.78 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -172.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -149.49 113.83 5.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.968 0.413 . . . . 0.0 110.173 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.824 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 22.9 m-85 -92.62 175.41 6.83 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.543 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 43.8 t -135.31 102.93 5.32 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.206 -178.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.454 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -85.62 91.34 8.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 m -86.65 121.23 28.88 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.08 -179.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.9 p -118.72 138.38 49.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.132 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -78.88 120.34 23.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.795 0.807 . . . . 0.0 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 9.5 t70 -107.26 76.06 1.06 Allowed 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.024 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.575 ' HA ' ' HA ' ' A' ' 54' ' ' LEU . 74.3 t80 -77.54 95.15 4.45 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.54 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -95.92 154.95 16.96 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.211 -177.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -84.15 -16.29 44.08 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.355 -173.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.99 -43.74 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.75 0.31 . . . . 0.0 111.165 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -82.69 -37.26 25.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.051 0.453 . . . . 0.0 110.818 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 108.61 -162.85 12.82 Favored Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 -176.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -79.61 104.99 10.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.676 0.751 . . . . 0.0 111.759 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.628 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 10.1 m-80 -102.14 157.18 17.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.322 178.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.0 t -112.79 115.56 50.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.143 0.497 . . . . 0.0 110.259 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -93.52 109.15 20.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.601 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -89.31 98.7 11.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.855 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -92.58 103.45 15.85 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -69.69 125.71 27.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.327 0.584 . . . . 0.0 111.048 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.824 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -91.97 93.9 4.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.38 155.18 23.64 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.023 -173.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 59.8 mtpt -105.43 146.63 29.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.792 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 65' ' ' ASP . 98.4 mt -78.8 -74.22 0.29 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.206 173.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 6.2 p-10 173.2 -44.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.543 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.7 p -136.86 -29.89 0.9 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.899 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.48 -44.76 97.58 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.766 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.42 -147.36 18.57 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.889 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -109.86 152.16 26.12 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.05 0.54 . . . . 0.0 109.684 -177.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -150.52 135.75 17.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.192 0.52 . . . . 0.0 111.305 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.653 HG12 HG12 ' A' ' 61' ' ' ILE . 66.5 mt -92.0 -24.02 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 122.198 0.999 . . . . 0.0 108.469 171.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.4 t -148.71 145.66 27.77 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.348 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -64.97 -21.4 66.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -169.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -86.48 -0.87 56.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.9 m -147.04 108.81 4.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.33 133.47 55.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.197 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -123.02 132.9 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.774 0.321 . . . . 0.0 110.622 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 m -79.45 3.4 18.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.6 m -150.68 132.63 15.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.57 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.7 mt -66.19 -25.32 66.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.682 -177.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -62.7 -46.8 86.45 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -66.67 -32.07 73.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.55 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.601 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -57.56 -65.95 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.302 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -62.54 -43.63 98.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.758 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.98 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.175 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -76.74 -43.56 36.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.729 0.3 . . . . 0.0 111.053 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 25.4 m-85 -70.73 -9.09 56.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.608 -177.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.646 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 70.6 m -67.45 -28.39 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.212 0.53 . . . . 0.0 110.013 173.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.49 -48.53 3.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.674 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 56.2 m170 -110.27 116.47 31.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.29 178.02 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.47 -38.01 65.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.814 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 61.02 -78.98 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.092 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.86 -40.59 5.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.739 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.627 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.17 149.36 50.59 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.956 0.408 . . . . 0.0 110.081 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 59.1 m -76.67 -17.93 58.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.537 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -133.04 134.02 43.83 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -68.95 151.27 46.75 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 74.2 mt -67.79 84.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.202 0.525 . . . . 0.0 109.848 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.8 m -73.82 -58.76 3.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.234 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -139.75 146.84 40.02 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.069 0.461 . . . . 0.0 110.095 -177.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.521 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.5 t -89.31 149.4 4.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.8 -179.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 18' ' ' LEU . 53.2 t -65.68 119.13 57.9 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.155 177.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.5 135.69 26.95 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.588 2.192 . . . . 0.0 112.465 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.0 p -81.7 114.17 20.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.762 176.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.0 t -130.86 123.49 29.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.559 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.103 0 O-C-N 123.744 0.653 . . . . 0.0 110.261 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 . . . . . 0 CA--C 1.514 -0.406 0 CA-C-O 120.29 0.09 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 30.42 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.788 1.635 . . . . 0.0 113.333 -173.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 5.1 p-90 -81.38 -34.78 31.47 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.997 -173.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.56 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 1.0 OUTLIER -86.45 88.45 7.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.083 0.468 . . . . 0.0 110.462 -174.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -75.98 -30.37 58.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.759 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.3 -157.72 14.76 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.737 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -82.49 57.52 3.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.484 0.659 . . . . 0.0 111.466 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.02 134.49 26.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -73.83 165.06 25.79 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.854 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' HE ' ' CD ' ' A' ' 16' ' ' GLU . 19.4 ttt180 -54.94 -49.57 71.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.743 -0.208 . . . . 0.0 111.238 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -61.5 -41.32 97.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.609 -175.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -61.57 -42.4 98.8 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.355 0.598 . . . . 0.0 110.019 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.2 t -67.83 -41.21 83.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.085 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.406 ' CD ' ' HE ' ' A' ' 12' ' ' ARG . 49.6 mt-10 -61.53 -42.19 98.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.503 0.192 . . . . 0.0 110.972 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -57.98 -35.37 71.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.334 . . . . 0.0 110.908 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -78.13 -40.94 36.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.804 HD21 HD22 ' A' ' 30' ' ' LEU . 97.2 mt -76.95 -39.21 51.44 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -174.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.01 38.16 0.27 Allowed 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.469 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 23.7 m-80 -89.51 118.75 69.34 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.23 -18.07 17.18 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.359 2.706 . . . . 0.0 113.461 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -86.58 -2.26 58.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.533 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.469 ' ND2' ' HB2' ' A' ' 21' ' ' ASN . 95.9 m-20 -84.89 131.89 47.69 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.813 0.339 . . . . 0.0 110.421 177.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -82.64 156.42 16.09 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.705 2.27 . . . . 0.0 111.919 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 33.8 ttp180 -61.64 123.32 17.57 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.096 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.51 -5.0 10.91 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.436 -175.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 87.0 m -66.06 114.38 5.17 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.908 0.416 . . . . 0.0 110.123 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 43.2 p90 -128.55 166.7 18.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.755 0.312 . . . . 0.0 111.625 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.804 HD22 HD21 ' A' ' 19' ' ' LEU . 1.7 pt? -169.11 152.03 4.94 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.3 p -110.54 119.28 59.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.443 0.64 . . . . 0.0 111.006 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 10.5 ptp85 -102.04 151.32 22.29 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.495 178.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -93.85 117.22 29.81 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -76.71 121.4 23.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 0.0 110.946 -174.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -91.98 -16.12 26.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.059 174.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 t -88.73 -13.88 38.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.627 0.727 . . . . 0.0 109.582 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.6 m -139.35 93.17 2.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.658 171.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -69.96 141.87 52.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.651 -173.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.54 64.96 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.872 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.35 144.2 33.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.027 0.442 . . . . 0.0 110.341 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.604 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.0 m-85 -113.52 172.78 6.76 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.2 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 39.9 t -140.01 112.16 7.64 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.786 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.55 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.4 tm? -85.33 102.34 13.3 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 173.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 t -99.51 124.67 44.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.653 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -118.22 138.15 49.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.125 0.488 . . . . 0.0 110.58 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.9 m -91.05 105.84 18.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.437 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.478 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 3.7 m-20 -88.8 169.11 11.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.189 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -143.68 123.92 13.78 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.448 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -128.13 135.51 49.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -80.94 51.84 1.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.773 0.797 . . . . 0.0 109.772 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.51 -26.29 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.282 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -114.11 -20.34 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.342 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.13 -158.32 34.5 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.9 mp -74.32 114.01 12.19 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.84 127.52 49.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.346 0.593 . . . . 0.0 110.57 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 98.6 t -86.06 121.37 37.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.056 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.567 ' NZ ' ' HB2' ' A' ' 57' ' ' LYS . 3.4 ttmp? -102.05 110.41 22.37 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.726 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -89.08 99.76 12.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.702 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.411 ' CD2' ' HG ' ' A' ' 94' ' ' LEU . 12.9 m-85 -91.11 142.93 27.22 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 13.0 mmmm -99.42 131.58 45.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.925 -172.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.604 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -98.5 98.82 7.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.706 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.464 HH11 ' HD2' ' A' ' 62' ' ' ARG . 54.6 mtt180 -83.21 150.82 25.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.926 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -109.79 128.27 55.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.288 0.566 . . . . 0.0 111.646 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.494 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 79.3 mt -90.37 136.53 33.0 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.73 -12.25 59.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.201 0.524 . . . . 0.0 110.851 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -135.43 42.15 2.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.38 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -159.05 -70.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.804 -178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 156.87 -123.65 1.33 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.276 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -119.91 144.49 47.4 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -175.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.429 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 15.3 p90 -156.94 136.61 12.34 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.531 . . . . 0.0 110.849 175.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 60' ' ' LYS . 58.8 mt -87.11 -30.21 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.094 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -140.74 157.21 45.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.447 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.4 m -74.69 42.53 0.17 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.252 0.548 . . . . 0.0 111.575 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -125.95 -71.9 0.68 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.546 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.408 HG21 ' CE2' ' A' ' 86' ' ' TYR . 0.2 OUTLIER -96.11 125.6 40.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.959 179.085 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -130.93 131.14 44.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.913 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.594 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 92.9 m-85 -130.9 146.54 52.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.705 -175.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.428 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 19.9 m -83.42 3.12 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 41.2 m -152.06 156.74 40.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.549 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.6 mt -66.38 -43.49 85.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.835 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -58.76 -47.34 85.04 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.841 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.477 ' HB3' ' HB3' ' A' ' 77' ' ' PHE . 20.4 tt0 -56.32 -35.1 67.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.115 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.441 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 7.9 tt -69.56 -60.49 2.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.886 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -60.84 -41.54 89.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -53.84 -45.79 71.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.748 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 75' ' ' THR . 66.6 t80 -71.57 -46.08 60.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.858 0.361 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.594 ' HE1' ' HE2' ' A' ' 77' ' ' PHE . 2.5 m-85 -66.55 -11.93 55.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.22 -177.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.2 t -72.34 -27.42 62.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 110.344 176.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -104.53 -48.64 3.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.351 0.596 . . . . 0.0 110.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.7 t-160 -113.54 108.23 16.89 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.93 87.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.505 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.3 t70 67.75 -67.03 0.19 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.758 174.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -110.06 -32.26 2.88 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.212 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.2 mp -69.46 155.79 39.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.063 0.458 . . . . 0.0 111.07 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 m -78.55 -19.43 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.462 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -142.43 135.04 28.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.235 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -74.37 144.85 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.006 0.432 . . . . 0.0 111.174 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 69.6 mt -56.83 109.76 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.63 -176.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.1 m -98.71 -60.09 1.61 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 -173.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.577 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.7 p-10 -134.63 147.22 50.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.749 -176.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.423 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.1 t -88.37 146.58 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -55.39 122.07 41.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 O-C-N 123.718 0.636 . . . . 0.0 111.307 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -78.02 136.14 14.51 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.29 1.994 . . . . 0.0 112.086 177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 C--N 1.322 -0.623 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.041 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 N--CA 1.454 -0.263 0 CA-C-O 121.088 0.47 . . . . 0.0 111.823 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -52.64 -39.45 61.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.506 -1.224 . . . . 0.0 113.423 -168.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -66.08 -33.35 75.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 79.2 t80 -83.47 99.93 10.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.776 0.322 . . . . 0.0 110.378 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.6 m-85 -83.68 -24.07 31.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.201 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.13 -166.14 13.35 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.86 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 44.6 pttt -86.69 78.81 9.05 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.632 0.73 . . . . 0.0 111.324 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 pt -97.79 149.81 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -76.53 171.01 15.33 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.83 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -58.18 -47.81 82.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.109 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.462 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 45.5 mtp180 -56.66 -41.6 77.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.166 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.88 -52.86 46.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.063 0.458 . . . . 0.0 110.531 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 6.9 m -62.14 -55.1 32.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.553 -174.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 56' ' ' VAL . 34.4 mt-10 -71.88 -22.51 61.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.094 -173.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 8.4 tpt180 -76.33 -23.23 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.059 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -88.85 -21.57 23.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.829 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.622 HD21 HD22 ' A' ' 30' ' ' LEU . 80.2 mt -93.88 -31.87 14.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.822 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.426 ' HA ' HD13 ' A' ' 20' ' ' LEU . 3.5 mm? -77.66 53.35 1.09 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.145 0.498 . . . . 0.0 111.298 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.523 ' HB2' ' OD1' ' A' ' 24' ' ' ASN . 87.3 m-20 -113.63 128.97 25.12 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 173.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.91 -12.2 21.3 Favored 'Trans proline' 0 N--CA 1.471 0.191 0 C-N-CA 122.843 2.362 . . . . 0.0 112.866 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -83.72 -33.63 25.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.796 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.523 ' OD1' ' HB2' ' A' ' 21' ' ' ASN . 4.3 m-20 -54.12 116.89 11.37 Favored Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.549 -178.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.96 151.44 24.1 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.487 2.124 . . . . 0.0 112.061 177.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -55.49 116.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.408 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.53 -2.89 9.49 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.804 -0.713 . . . . 0.0 111.958 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.503 ' HB ' ' HB2' ' A' ' 46' ' ' SER . 46.3 m -73.05 121.86 20.83 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 175.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -134.9 159.11 42.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.036 0.446 . . . . 0.0 111.873 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.622 HD22 HD21 ' A' ' 19' ' ' LEU . 2.3 pt? -155.59 137.35 14.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.97 170.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.4 p -99.8 114.48 38.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.717 0.77 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 ptt85 -115.11 160.17 19.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.575 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.663 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.9 tt0 -99.78 139.75 34.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.508 ' HB3' HG22 ' A' ' 36' ' ' THR . 45.6 m -100.11 115.77 30.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.292 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -64.32 -17.26 63.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.009 -174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.508 HG22 ' HB3' ' A' ' 34' ' ' SER . 10.6 t -61.47 -22.17 64.83 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.713 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.0 m -151.49 102.08 2.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.511 ' NZ ' ' HB2' ' A' ' 38' ' ' LYS . 4.4 ttmp? -55.61 113.36 1.42 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.095 -177.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.97 -2.2 48.01 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.612 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -100.01 112.96 25.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.793 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 75.5 m-85 -96.43 161.88 13.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.075 -177.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.53 117.7 19.12 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.83 176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -82.38 85.6 6.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.411 ' O ' HD23 ' A' ' 30' ' ' LEU . 19.2 m -74.46 111.9 10.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.907 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.8 p -107.86 136.86 41.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.006 0.431 . . . . 0.0 110.742 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.503 ' HB2' ' HB ' ' A' ' 28' ' ' THR . 15.4 m -81.04 107.55 13.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.875 176.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -102.86 147.87 26.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.849 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.559 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 88.1 t80 -133.46 113.7 12.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.404 0.621 . . . . 0.0 110.534 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -96.68 139.47 32.7 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.667 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -81.48 49.83 1.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.281 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -171.32 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.537 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -105.2 5.81 32.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.667 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.02 -146.62 38.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.138 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.559 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.1 mp -96.29 147.0 24.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 0.0 110.891 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -143.67 154.56 43.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.399 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.418 HG21 ' HG2' ' A' ' 16' ' ' GLU . 84.1 t -108.15 120.01 58.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 120.976 0.417 . . . . 0.0 111.078 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -102.14 114.42 28.54 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.688 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -89.71 86.04 6.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.052 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.408 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 49.9 m-85 -69.0 129.24 39.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.838 0.351 . . . . 0.0 110.805 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 38.9 mmtm -75.03 122.24 23.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.505 -172.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 59.2 mt -107.29 87.24 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -110.74 163.17 14.03 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.496 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 36.3 mtmm -99.29 150.17 22.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.34 0.59 . . . . 0.0 111.73 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.511 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 68.7 mt -95.56 177.11 5.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.79 -1.095 . . . . 0.0 109.993 172.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -51.23 -58.16 6.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.437 0.46 . . . . 0.0 110.897 175.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 p -142.21 14.43 2.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.045 0.45 . . . . 0.0 111.547 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -84.71 -32.96 20.33 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.348 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 110.19 -144.61 17.01 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.829 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -93.92 143.26 26.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.511 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 13.1 p90 -154.86 139.63 17.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.933 0.397 . . . . 0.0 110.74 177.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.65 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 62.1 mt -97.12 -26.27 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 122.071 0.939 . . . . 0.0 108.505 171.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.479 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.3 t -136.37 144.04 44.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.069 -1.423 . . . . 0.0 108.678 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.3 m -68.82 -15.74 63.59 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -170.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HD2' ' OD1' ' A' ' 92' ' ' ASP . 61.5 mtt85 -71.32 -58.74 3.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 0.0 110.874 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.42 HG21 ' CE1' ' A' ' 86' ' ' TYR . 25.1 m -102.54 124.08 47.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.28 -175.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -124.93 137.29 54.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.829 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -137.53 135.75 37.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.669 0.271 . . . . 0.0 110.784 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.0 m -88.38 14.18 10.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.152 0.501 . . . . 0.0 110.702 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 29.0 m -143.65 132.05 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.784 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.449 ' O ' HG22 ' A' ' 84' ' ' VAL . 88.6 mt -66.93 -25.29 66.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.06 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -48.11 79.09 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.95 -32.8 74.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.524 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -54.67 -64.8 0.72 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.534 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -66.64 -40.8 87.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.089 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.55 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.924 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.42 ' CE1' HG21 ' A' ' 75' ' ' THR . 60.9 t80 -93.04 -47.33 7.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.696 0.284 . . . . 0.0 111.04 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.65 ' HE2' ' HB ' ' A' ' 71' ' ' ILE . 2.8 m-85 -68.75 -9.0 48.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.035 -175.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.649 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 5.8 p -72.69 -33.37 66.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.374 0.607 . . . . 0.0 110.33 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -100.86 -39.83 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.678 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 34.3 m170 -115.47 111.99 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.93 -33.81 64.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.993 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.492 ' OD1' ' HD2' ' A' ' 74' ' ' ARG . 9.8 t70 62.9 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.566 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -101.23 -32.0 5.4 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 121.237 -0.506 . . . . 0.0 112.088 -178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.615 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -68.6 152.51 45.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 74.1 m -90.75 13.13 17.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 109.851 174.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -140.18 134.39 31.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.653 -175.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -97.78 120.22 37.78 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 63.9 mt -52.25 106.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 111.201 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.2 m -98.8 -58.47 1.94 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.269 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 p30 -135.45 151.95 50.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -90.23 146.41 6.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 120.773 0.32 . . . . 0.0 110.191 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 49.8 t -52.56 133.93 44.84 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.821 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.9 Cg_exo -65.9 135.73 42.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.796 2.331 . . . . 0.0 111.011 173.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.545 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -177.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.667 0.27 . . . . 0.0 111.327 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.444 ' O ' HG11 ' A' ' 101' ' ' VAL . 15.6 mm-40 -50.11 -51.91 39.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.604 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.535 ' CD1' HG21 ' A' ' 84' ' ' VAL . 1.2 p-90 -84.61 -23.71 29.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.163 -173.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.432 ' HA ' HG13 ' A' ' 31' ' ' VAL . 23.0 t80 -85.18 106.73 16.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.552 -173.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.6 -21.75 26.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.878 0.37 . . . . 0.0 111.098 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.08 -163.57 12.35 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.48 -0.867 . . . . 0.0 113.489 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -83.84 56.63 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.817 0.447 . . . . 0.0 111.219 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.538 ' O ' ' HD2' ' A' ' 32' ' ' ARG . 39.5 pt -90.41 139.21 17.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.084 0.468 . . . . 0.0 110.092 177.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -78.76 177.56 8.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.755 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -55.26 -46.82 76.09 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -177.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -56.12 -48.5 76.08 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.787 -177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -59.9 -36.12 76.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.241 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -64.38 -52.83 56.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.82 0.343 . . . . 0.0 110.449 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -70.11 -29.28 66.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.648 -179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -57.75 -40.01 78.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.019 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.2 mt -88.04 -31.15 19.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.873 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.55 HD21 HD22 ' A' ' 30' ' ' LEU . 59.9 mt -82.39 -30.65 30.08 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -172.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' HA ' HD13 ' A' ' 20' ' ' LEU . 1.9 mm? -77.52 26.65 0.17 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.241 0.473 . . . . 0.0 112.216 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -99.17 120.03 59.21 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.21 -3.63 4.25 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 C-N-CA 123.42 2.747 . . . . 0.0 114.034 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -77.57 -12.68 59.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.467 . . . . 0.0 110.463 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -83.83 124.65 74.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.998 -178.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.89 151.01 27.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.56 2.173 . . . . 0.0 112.232 175.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -56.28 113.46 1.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.687 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.55 10.04 8.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.192 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 88.2 m -83.35 114.89 21.73 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.301 0.24 . . . . 0.0 110.454 176.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -122.5 162.51 21.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 111.259 -175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.55 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -159.18 128.48 5.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.541 172.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.468 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 p -94.97 121.06 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.759 0.79 . . . . 0.0 110.659 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 38.3 ptt85 -108.69 160.1 16.22 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.794 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -92.71 135.96 33.65 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -97.38 101.06 12.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.35 -34.8 58.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.942 -171.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.8 p -86.49 19.3 2.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -173.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.505 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 26.5 m -152.2 124.29 8.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.963 0.411 . . . . 0.0 110.087 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -70.32 104.75 2.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.611 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.93 5.78 65.89 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.083 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.505 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -95.07 113.86 25.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.276 0.56 . . . . 0.0 110.312 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 71.9 m-85 -104.76 169.23 8.57 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.227 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.3 m -133.51 108.88 8.89 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.961 0.41 . . . . 0.0 110.542 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -83.07 84.77 7.34 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.5 t -81.27 127.82 33.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.383 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 13.9 p -125.61 138.61 53.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.0 t -78.25 119.45 21.64 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.725 0.774 . . . . 0.0 110.293 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -95.78 153.48 17.72 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.591 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -135.89 107.74 7.08 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.957 -175.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -90.77 139.81 30.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 173.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -84.13 -2.04 56.07 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -172.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -120.21 -51.22 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -84.62 -25.81 28.3 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.588 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.22 -166.69 12.17 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.081 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.623 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.5 pt? -79.3 146.25 33.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.104 0.478 . . . . 0.0 111.496 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -137.12 178.18 7.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.148 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 99.3 t -121.97 128.73 75.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.024 0.44 . . . . 0.0 110.306 177.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -111.26 95.53 5.58 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.547 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -76.94 91.58 3.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.458 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.489 ' HB3' HG23 ' A' ' 71' ' ' ILE . 70.4 m-85 -78.18 137.06 37.96 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -104.82 133.68 49.24 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.145 0.498 . . . . 0.0 110.982 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 71' ' ' ILE . 66.6 mt -104.23 96.38 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.103 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.7 ttp180 -88.22 134.69 33.72 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.969 0.414 . . . . 0.0 110.421 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -82.42 127.73 33.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.773 177.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.7 mt -99.64 115.33 29.18 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.237 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.01 -25.74 67.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.326 0.584 . . . . 0.0 110.089 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -99.29 11.43 39.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.239 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.51 -102.43 0.18 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.955 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -161.78 -136.38 1.99 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.25 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -114.39 138.61 50.33 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.413 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 13.7 p90 -147.91 143.33 27.29 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.102 0.477 . . . . 0.0 110.959 177.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 61' ' ' ILE . 57.9 mt -95.75 -36.76 6.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.159 174.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.01 148.18 52.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.365 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.454 ' O ' ' HD2' ' A' ' 74' ' ' ARG . 14.4 p -78.91 47.04 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -172.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 73' ' ' SER . 30.6 mmm180 -125.44 -62.72 1.19 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.4 m -108.93 133.4 53.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.63 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.413 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 72.6 mt-30 -129.17 135.22 48.56 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.538 0.209 . . . . 0.0 110.501 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -121.11 155.38 34.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.874 0.369 . . . . 0.0 110.867 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 p -93.41 -7.72 43.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 31.7 p -132.51 139.29 47.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.995 0.426 . . . . 0.0 110.146 177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.646 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.4 mt -68.47 -26.56 65.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.915 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -62.8 -47.3 84.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -71.23 -29.91 65.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.334 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.604 HD11 HD11 ' A' ' 71' ' ' ILE . 3.1 tm? -56.88 -62.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.045 176.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.8 m -64.35 -44.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.05 -46.28 71.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.74 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -73.78 -39.88 63.83 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.258 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 6.6 m-85 -74.0 -3.73 31.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.112 0.482 . . . . 0.0 111.536 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -82.26 -27.06 32.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 170.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.1 mttm -96.24 -49.91 5.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.807 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.618 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 35.1 m170 -125.53 119.29 27.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.2 174.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -70.45 -17.59 62.99 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.6 t70 66.55 -72.15 0.09 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.846 0.716 . . . . 0.0 111.193 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -116.31 -33.68 1.44 Allowed Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.623 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.4 mp -61.69 169.78 2.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.256 0.551 . . . . 0.0 111.057 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 41.8 t -116.35 -22.75 8.66 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.135 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 53.3 m80 -87.42 -32.02 19.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.202 -170.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 96' ' ' HIS . 49.5 mtp180 66.82 124.82 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.556 0.535 . . . . 0.0 110.018 -168.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 82.5 mt -61.03 104.45 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.607 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.6 m -96.02 -66.02 0.93 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.304 -173.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.9 p30 -133.02 150.13 52.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.51 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.7 t -89.91 145.72 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.1 t -46.33 130.38 7.77 Favored Pre-proline 0 C--O 1.234 0.256 0 O-C-N 123.99 0.807 . . . . 0.0 112.308 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.45 151.5 82.94 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.043 2.495 . . . . 0.0 111.916 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 C--N 1.318 -0.769 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.573 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 110.599 -0.148 . . . . 0.0 110.599 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -45.01 -48.44 11.57 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.49 ' HE3' HG11 ' A' ' 31' ' ' VAL . 7.7 p-90 -81.84 -43.03 18.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.651 0.262 . . . . 0.0 111.447 -178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 1.9 t80 -85.68 87.41 7.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.359 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.48 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 7.7 m-85 -67.04 -41.15 87.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.822 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.32 -165.61 18.41 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.752 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 pttm -84.29 73.65 10.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.506 0.669 . . . . 0.0 111.587 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.8 pt -94.61 144.99 8.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.986 175.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -84.23 177.53 8.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.244 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.468 ' HB3' ' OE2' ' A' ' 16' ' ' GLU . 25.1 mtp180 -56.08 -50.15 71.8 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 13' ' ' ARG . 52.9 mtp180 -52.86 -37.51 60.43 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.365 -178.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -79.45 -47.57 15.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.1 m -61.38 -49.24 77.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.984 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.468 ' OE2' ' HB3' ' A' ' 12' ' ' ARG . 42.1 mt-10 -68.27 -30.02 68.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.978 -177.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -59.89 -52.01 67.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.039 0.447 . . . . 0.0 110.858 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.522 HD22 ' OG1' ' A' ' 104' ' ' THR . 79.0 mt -70.12 -33.8 72.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.512 -174.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.771 HD21 HD22 ' A' ' 30' ' ' LEU . 55.1 mt -79.76 -32.9 41.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mp -81.27 8.78 8.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.79 0.328 . . . . 0.0 111.327 177.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.848 HD22 ' HG2' ' A' ' 23' ' ' GLU . 7.0 t30 -67.52 126.68 92.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 175.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.54 23.66 0.17 Allowed 'Trans proline' 0 N--CA 1.478 0.597 0 C-N-CA 123.493 2.795 . . . . 0.0 115.514 -167.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.848 ' HG2' HD22 ' A' ' 21' ' ' ASN . 11.3 pt-20 -122.34 10.35 9.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.312 0.577 . . . . 0.0 110.063 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -96.83 122.12 57.62 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.274 -177.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -86.72 169.58 7.89 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.898 2.399 . . . . 0.0 111.758 173.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -61.89 112.2 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.591 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.69 2.8 6.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.399 -177.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 35.1 m -80.42 118.51 22.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CG ' HD22 ' A' ' 98' ' ' LEU . 28.7 p90 -129.78 165.83 21.14 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -173.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.771 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -164.64 145.84 8.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.3 171.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.49 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -108.15 124.45 64.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.328 0.585 . . . . 0.0 110.961 178.704 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.571 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 5.2 ptp180 -102.25 158.3 16.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.224 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -91.29 101.38 14.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 40' ' ' ALA . 34.5 t -73.93 111.78 9.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.111 0.481 . . . . 0.0 110.827 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.19 59.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 175.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 m -64.44 -36.33 83.83 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.813 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.9 m -147.6 109.46 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.325 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.59 132.84 53.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 92.01 1.74 69.76 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.827 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.543 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . -125.27 116.26 21.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.018 0.437 . . . . 0.0 109.864 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 90.4 m-85 -97.05 176.49 5.93 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.571 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 41.2 t -135.45 112.78 10.57 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.761 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.1 tm? -87.05 88.31 7.67 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 15.4 m -82.35 116.11 21.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.968 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 p -110.51 130.89 63.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.082 0.468 . . . . 0.0 110.038 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.497 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 41.4 t -78.24 122.58 25.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.341 177.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -116.87 123.68 47.63 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.943 -174.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.507 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 51.9 t80 -101.84 72.82 1.37 Allowed 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.54 ' HB2' ' HG2' ' A' ' 52' ' ' LYS . 15.5 m-20 -61.1 124.45 20.58 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.633 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.447 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -75.26 53.1 0.63 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.567 0.699 . . . . 0.0 110.834 -179.456 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -162.22 -51.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.742 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.54 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 10.0 ptpp? -99.28 -23.58 15.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.173 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 97.89 -158.72 20.78 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.366 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 35.4 mt -64.55 120.67 12.78 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.403 0.621 . . . . 0.0 111.343 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.442 ' ND2' ' HD2' ' A' ' 52' ' ' LYS . 8.1 p30 -143.1 146.35 33.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.453 176.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.3 t -89.14 119.71 36.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HZ2' ' HB2' ' A' ' 57' ' ' LYS . 3.5 ttmp? -95.99 100.81 12.44 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -80.07 89.84 5.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.303 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -78.5 142.85 37.12 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -115.01 117.38 30.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.178 0.514 . . . . 0.0 110.76 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.683 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 63.5 mt -87.86 92.74 3.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.792 -178.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -100.2 144.01 29.73 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.911 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.67 157.77 19.0 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.791 -0.363 . . . . 0.0 110.056 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.415 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 7.7 mt -70.1 -91.69 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.956 176.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -134.16 -34.37 0.98 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.6 t -149.07 -31.13 0.24 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.068 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.48 68.57 0.36 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.51 -1.329 . . . . 0.0 113.519 -172.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -178.28 94.6 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.758 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -83.05 125.41 31.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.437 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 15.8 p90 -126.06 132.72 51.89 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.498 0.666 . . . . 0.0 111.768 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.63 HG21 HD11 ' A' ' 94' ' ' LEU . 65.4 mt -93.35 -39.69 11.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 168.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -121.16 179.79 4.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.891 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.0 t -73.18 -43.74 60.94 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -69.54 -56.71 6.58 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -170.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.451 ' HB ' ' CE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.68 120.59 32.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -169.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.437 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 2.2 mp0 -111.99 131.8 55.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.788 170.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.462 ' CE2' ' HE1' ' A' ' 87' ' ' TYR . 98.9 m-85 -123.28 131.34 53.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.636 0.255 . . . . 0.0 110.465 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.29 5.23 27.54 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.86 0.362 . . . . 0.0 111.783 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.1 m -147.7 137.54 22.74 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.961 0.41 . . . . 0.0 110.404 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.592 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.8 mt -72.75 -30.13 63.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.427 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -48.5 81.55 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -62.79 -35.72 80.79 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.565 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 HD11 ' A' ' 71' ' ' ILE . 2.8 tm? -58.34 -60.94 2.99 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.825 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -65.17 -44.13 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.48 -39.6 70.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.876 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -73.76 -48.52 31.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.592 0.235 . . . . 0.0 111.018 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 2.4 m-30 -69.99 -10.79 59.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.356 -177.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.513 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 10.7 t -70.28 -19.57 63.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.247 0.546 . . . . 0.0 110.132 176.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -116.15 -52.41 2.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.852 177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.517 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.1 t-160 -116.8 103.48 10.37 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.485 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -68.81 -27.34 65.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 -177.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.5 t70 70.11 -73.74 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.5 174.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.46 -49.57 2.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.794 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.74 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.3 mp -60.85 144.57 52.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.069 0.461 . . . . 0.0 110.643 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.9 t -74.6 -39.13 62.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -89.56 121.59 31.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.142 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.653 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -81.61 146.65 29.98 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.588 HD22 ' CG ' ' A' ' 29' ' ' PHE . 73.9 mt -69.04 85.68 0.35 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.218 0.532 . . . . 0.0 110.416 -177.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.7 m -78.17 -58.7 3.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.335 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.453 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.7 p-10 -132.94 143.74 49.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.949 -177.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.488 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -82.7 152.27 4.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.78 140.15 81.44 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.31 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.12 176.47 3.84 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.67 2.247 . . . . 0.0 111.167 172.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.522 ' OG1' HD22 ' A' ' 18' ' ' LEU . 24.0 p . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 123.463 0.705 . . . . 0.0 110.797 -173.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 52.8 mm-40 . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -61.55 -52.46 64.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.002 0.429 . . . . 0.0 110.066 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 14.9 p-90 -79.79 -41.06 27.27 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.038 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.576 ' HE1' ' CE2' ' A' ' 41' ' ' TYR . 80.0 t80 -85.66 95.57 9.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.929 -177.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.583 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 30.6 m-85 -79.92 -20.96 44.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.209 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.76 -164.34 21.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.974 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 7.3 pttm -81.72 74.95 8.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.117 0.484 . . . . 0.0 111.846 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.678 HG13 ' HD2' ' A' ' 32' ' ' ARG . 39.4 pt -97.41 145.21 9.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -75.08 165.68 24.85 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.447 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 57.9 mtm180 -56.84 -51.0 70.72 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.104 0.252 . . . . 0.0 110.468 -176.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -49.48 -48.85 47.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.661 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.55 -47.58 84.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.299 0.571 . . . . 0.0 110.335 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 45.2 t -64.29 -47.3 80.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.326 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.496 ' HA ' HG21 ' A' ' 56' ' ' VAL . 48.3 mt-10 -68.96 -34.75 75.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.589 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.4 -25.05 68.11 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.489 . . . . 0.0 110.336 177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -88.07 -39.37 14.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.519 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.539 HD21 HD22 ' A' ' 30' ' ' LEU . 88.4 mt -77.02 -25.46 52.64 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.4 mm? -77.54 4.4 11.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.6 t30 -83.14 109.77 19.41 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.1 Cg_exo -65.67 14.39 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.883 3.055 . . . . 0.0 114.409 -170.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -83.54 -3.67 57.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.785 0.326 . . . . 0.0 110.51 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -110.96 143.22 27.84 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.541 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -82.0 164.41 17.7 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 123.09 2.527 . . . . 0.0 112.458 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.498 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 54.4 ttp180 -68.82 106.25 2.62 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.868 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.93 2.92 2.08 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 -174.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 68.8 m -76.64 132.46 39.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.198 -0.501 . . . . 0.0 109.757 175.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.564 ' CG ' HD22 ' A' ' 98' ' ' LEU . 31.0 p90 -137.04 166.33 23.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.158 0.504 . . . . 0.0 112.002 -175.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.583 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.3 pt? -162.51 141.9 9.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.391 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.75 118.16 55.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.502 0.668 . . . . 0.0 110.666 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.678 ' HD2' HG13 ' A' ' 10' ' ' ILE . 11.3 mtm180 -104.58 162.07 13.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.179 -177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.653 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.2 tt0 -97.63 129.91 44.69 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 174.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.2 m -67.85 140.98 56.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.519 0.676 . . . . 0.0 111.317 -176.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.74 -38.5 91.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.83 -177.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.6 p -103.21 -66.65 0.93 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.563 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.2 m -70.74 99.33 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.152 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.25 133.35 37.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.945 0.402 . . . . 0.0 109.923 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.69 -11.16 61.06 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -173.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.553 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -104.15 126.46 51.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.576 ' CE2' ' HE1' ' A' ' 6' ' ' TYR . 60.3 m-85 -117.34 143.33 46.07 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.175 0.512 . . . . 0.0 111.09 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.7 m -99.16 94.13 6.34 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 -176.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.723 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.2 tm? -81.24 98.38 8.07 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 172.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.7 m -97.86 132.83 43.11 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.729 -175.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.535 HG21 HD23 ' A' ' 94' ' ' LEU . 3.0 t -112.61 139.44 37.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.927 -177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.402 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 78.6 p -77.41 96.73 4.74 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.708 0.766 . . . . 0.0 109.388 174.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.81 138.81 31.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.596 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.498 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 79.7 t80 -122.59 122.45 38.88 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.302 0.572 . . . . 0.0 110.972 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -106.59 152.53 23.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.146 173.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -84.13 -1.92 55.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.746 0.307 . . . . 0.0 111.289 -173.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -123.2 -44.64 2.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.883 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -82.06 -25.52 34.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.164 -177.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.76 -141.58 17.25 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.815 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 78.5 mt -82.86 137.5 34.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.249 0.547 . . . . 0.0 111.322 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -146.4 154.83 42.08 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.496 HG21 ' HA ' ' A' ' 16' ' ' GLU . 58.3 t -97.83 115.56 38.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.966 -178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -89.98 105.72 18.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.679 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -86.7 107.26 18.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.885 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.619 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 4.0 m-85 -95.85 135.0 38.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.959 0.409 . . . . 0.0 110.713 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -95.34 102.7 14.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 71' ' ' ILE . 54.8 mt -82.24 87.01 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.1 mtm180 -86.01 156.07 20.6 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -107.94 155.49 20.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.297 0.57 . . . . 0.0 111.328 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 95.7 mt -108.18 141.21 40.27 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.912 -1.04 . . . . 0.0 108.868 172.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -64.3 -25.42 68.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.6 t -135.44 45.03 2.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.099 0.476 . . . . 0.0 110.13 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.09 -77.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.44 -157.03 28.62 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.005 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.459 ' HB3' ' CG2' ' A' ' 61' ' ' ILE . 73.5 m-85 -99.36 136.28 39.53 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.505 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 52.3 p90 -140.04 137.65 34.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.243 0.544 . . . . 0.0 111.078 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 61' ' ' ILE . 45.2 mt -82.63 -26.73 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.898 0.856 . . . . 0.0 109.385 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' HB2' ' A' ' 74' ' ' ARG . 8.8 t -155.59 167.87 28.98 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.269 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.9 t -80.71 54.39 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.686 0.755 . . . . 0.0 109.738 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.602 ' HB2' HG23 ' A' ' 72' ' ' THR . 13.7 mmm180 -126.34 -78.64 0.59 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.539 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.0 m -105.04 131.72 52.19 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.505 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 73.9 mt-30 -126.43 125.62 42.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.759 0.314 . . . . 0.0 110.8 -176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -121.54 141.11 51.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.312 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -78.49 -0.92 31.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -174.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.6 m -153.48 161.38 42.31 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.414 ' O ' HG22 ' A' ' 84' ' ' VAL . 96.0 mt -81.21 -19.8 42.46 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -168.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.6 tp60 -68.2 -45.19 74.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.648 HE21 ' HA ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER -59.48 -32.86 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.898 175.059 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.474 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -59.64 -63.92 1.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.413 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.428 HG22 ' H ' ' A' ' 84' ' ' VAL . 0.1 OUTLIER -64.16 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -176.338 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.72 -32.87 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -90.42 -44.58 9.55 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.223 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.584 ' HD2' HD13 ' A' ' 94' ' ' LEU . 16.1 m-85 -74.6 -7.16 52.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 23.0 p -79.26 -21.39 46.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.156 0.503 . . . . 0.0 109.707 172.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -100.96 -47.82 4.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.057 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 93.3 m-70 -127.14 117.79 23.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.446 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -67.55 -29.77 69.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.076 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.5 t70 64.75 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.561 0.538 . . . . 0.0 112.442 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -93.53 -34.84 6.44 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.646 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.0 mp -72.14 159.08 34.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.33 -0.435 . . . . 0.0 110.204 174.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 18.3 t -103.54 2.4 33.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.763 0.792 . . . . 0.0 108.877 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -123.91 112.05 16.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.311 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.9 ptt180 -68.49 136.48 53.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.4 mt -60.33 97.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.376 0.423 . . . . 0.0 109.977 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 11.2 m -89.68 -46.9 8.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.076 0.465 . . . . 0.0 111.291 -172.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.5 p-10 -146.92 154.17 40.98 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.703 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.9 t -91.62 155.37 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -177.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 43.2 t -54.3 120.22 24.61 Favored Pre-proline 0 C--O 1.236 0.347 0 O-C-N 123.535 0.522 . . . . 0.0 111.865 -177.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.9 Cg_exo -69.58 139.35 40.63 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 111.383 175.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -177.907 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 121.215 0.531 . . . . 0.0 111.449 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -76.65 -42.94 40.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.525 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -75.26 -37.0 61.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.301 -172.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -86.35 105.23 16.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 0.0 110.68 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.493 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 22.7 m-85 -90.8 -11.41 39.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.32 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.74 -158.21 24.98 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.674 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 66.03 4.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.84 141.92 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.6 p -84.99 170.35 13.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.913 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -54.43 -51.06 66.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.702 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 35.7 ttp180 -53.37 -40.23 64.82 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.511 0.507 . . . . 0.0 110.793 -177.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -68.19 -53.61 23.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.498 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.2 m -61.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.235 -177.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.19 -24.04 63.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.208 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 38.6 ttp-105 -62.8 -37.97 88.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.789 176.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.31 -33.71 32.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.17 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.677 HD21 HD22 ' A' ' 30' ' ' LEU . 92.2 mt -78.87 -31.55 45.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -172.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.61 10.64 3.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 5.4 m-20 -86.55 125.36 67.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-O 120.716 0.294 . . . . 0.0 110.329 175.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 14.3 Cg_exo -69.88 8.48 0.79 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.3 2.667 . . . . 0.0 112.57 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -82.43 -15.6 52.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.779 177.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -92.34 133.5 29.82 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.945 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.448 ' HG2' ' ND2' ' A' ' 100' ' ' ASN . 57.5 Cg_endo -73.61 144.28 35.44 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.858 2.372 . . . . 0.0 111.631 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.589 ' HD3' ' O ' ' A' ' 48' ' ' PHE . 43.6 ttp180 -52.68 114.35 1.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.486 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.58 7.07 6.39 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.432 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 51.7 m -72.19 116.43 12.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.0 110.872 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.539 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.8 p90 -126.61 165.99 18.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.926 0.393 . . . . 0.0 111.203 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.677 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -164.0 142.49 7.48 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 171.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.4 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -106.68 124.24 62.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.674 0.75 . . . . 0.0 110.775 -179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 15.8 ptt180 -115.14 147.69 39.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.249 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -78.7 121.58 24.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.131 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.8 m -96.62 119.72 35.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.271 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.55 -22.71 40.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.073 -174.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.0 m -69.37 -21.88 63.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.009 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 39' ' ' GLY . 97.4 m -149.92 120.3 7.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.451 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -81.16 15.22 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.206 0.527 . . . . 0.0 111.34 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.632 ' H ' HG22 ' A' ' 37' ' ' THR . . . -134.2 22.48 3.77 Favored Glycine 0 C--N 1.307 -1.048 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.065 -176.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.35 108.75 2.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.791 0.329 . . . . 0.0 111.339 -178.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.688 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 35.3 m-85 -85.93 152.77 22.69 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 170.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.463 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -109.79 105.81 15.17 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.674 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -90.33 91.82 8.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 173.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -87.48 107.83 18.75 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.973 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.1 p -108.15 130.69 60.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.993 0.425 . . . . 0.0 110.475 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 42.7 t -87.36 124.2 33.13 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.628 0.727 . . . . 0.0 109.918 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.424 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 12.3 t70 -120.42 135.41 55.05 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.093 -176.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.589 ' O ' ' HD3' ' A' ' 26' ' ' ARG . 75.0 t80 -116.74 149.07 40.48 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.801 -178.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.519 ' HB3' ' HB3' ' A' ' 52' ' ' LYS . 16.7 t70 -140.93 146.37 37.31 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -73.4 -13.87 61.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.3 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.52 -37.67 2.75 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 6.9 ttpm? -83.87 -25.23 30.42 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.862 0.363 . . . . 0.0 111.358 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.68 -164.98 34.75 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.929 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.9 mt -76.45 139.23 40.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.56 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -150.63 143.1 24.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.036 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.23 119.79 57.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.073 0.464 . . . . 0.0 110.4 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 44.0 mttm -94.19 99.46 11.71 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.67 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -80.99 86.81 6.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.319 -0.401 . . . . 0.0 109.93 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 45.5 m-85 -75.91 141.99 42.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.075 0.464 . . . . 0.0 110.885 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -98.69 109.36 22.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.778 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 71' ' ' ILE . 54.3 mt -84.02 92.09 2.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.498 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -76.57 146.68 38.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.73 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.845 ' HE2' ' HA ' ' A' ' 65' ' ' ASP . 21.2 ptmt -110.89 148.54 32.23 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.207 0.527 . . . . 0.0 110.602 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.1 mt -90.13 26.98 1.73 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.666 173.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.845 ' HA ' ' HE2' ' A' ' 63' ' ' LYS . 13.4 t70 63.91 -66.26 0.11 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.879 -174.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 54.9 m -125.04 -11.71 7.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -177.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -79.45 -18.13 74.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.834 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.5 -170.43 23.03 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.154 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -120.45 138.41 53.81 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.653 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 38.5 p90 -143.81 130.16 19.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.36 0.6 . . . . 0.0 111.569 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 61' ' ' ILE . 69.5 mt -77.97 -42.7 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.138 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.5 t -115.45 151.33 34.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.13 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.2 p -76.06 21.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.951 0.405 . . . . 0.0 112.045 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -104.69 -52.66 2.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.244 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.3 m -125.19 112.03 15.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.047 0.451 . . . . 0.0 111.714 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.653 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -109.85 150.87 27.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.354 176.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.469 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 88.0 m-85 -128.45 149.69 50.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.2 m -76.96 -12.05 59.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.212 0.529 . . . . 0.0 110.993 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 16.7 m -138.06 136.6 36.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.998 -177.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.558 ' O ' HG22 ' A' ' 84' ' ' VAL . 91.8 mt -69.83 -22.32 63.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.981 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -48.55 76.29 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.86 -34.76 78.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.413 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -55.2 -62.38 1.71 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.504 178.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -63.32 -41.63 93.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.856 -176.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.3 71.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.22 -43.04 65.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.207 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 5.8 m-85 -75.83 -2.11 28.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.138 0.494 . . . . 0.0 111.468 -176.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.0 t -78.96 -21.17 47.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.352 0.596 . . . . 0.0 109.392 172.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HE3' ' HB3' ' A' ' 89' ' ' LYS . 22.8 mtpp -109.13 -49.5 3.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.979 177.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.608 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 76.0 m-70 -111.65 101.11 9.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.5 177.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -69.97 -33.97 72.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 t70 62.94 -82.79 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.249 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.17 -42.38 8.75 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.707 -0.557 . . . . 0.0 111.707 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.611 ' HB2' ' HB1' ' A' ' 91' ' ' ALA . 5.3 mp -63.04 143.17 58.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.244 0.545 . . . . 0.0 110.939 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.0 -17.81 60.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -140.32 132.71 28.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.314 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.592 ' H ' ' HD2' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -69.19 142.54 54.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.929 -179.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -60.87 109.77 1.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.169 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -98.97 -51.49 3.84 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -171.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 28' ' ' THR . 7.7 p30 -145.0 148.95 34.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.0 t -89.24 143.81 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 51.4 t -55.81 126.54 65.54 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.058 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 20.6 Cg_exo -65.95 129.69 22.61 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.713 2.275 . . . . 0.0 111.162 174.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t . . . . . 0 C--N 1.319 -0.717 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.978 -178.877 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.6 mm-40 . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 28.19 -78.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 125.461 1.726 . . . . 0.0 114.342 -170.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.453 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 10.7 p-90 -76.77 -35.56 57.63 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.546 -174.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.456 ' HA ' HG13 ' A' ' 31' ' ' VAL . 88.3 t80 -94.93 99.99 11.92 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.202 -176.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.636 ' HD2' ' HB2' ' A' ' 30' ' ' LEU . 42.2 m-85 -88.81 9.04 26.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.879 0.371 . . . . 0.0 111.923 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.01 -144.71 22.03 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.991 174.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -100.14 68.86 1.47 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.392 0.615 . . . . 0.0 111.636 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.0 pt -90.77 137.38 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.473 172.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -73.35 165.97 24.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.592 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -60.46 -37.8 82.15 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.581 -173.119 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 28.2 tpt180 -66.02 -40.32 90.98 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.528 -178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.57 -45.84 88.63 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.987 0.422 . . . . 0.0 110.598 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -61.94 -48.88 78.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.814 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -67.93 -33.52 74.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.891 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 tpt85 -58.13 -29.14 65.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.018 0.437 . . . . 0.0 110.505 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.95 -38.99 14.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.953 177.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.612 HD21 HD22 ' A' ' 30' ' ' LEU . 76.8 mt -74.88 -20.05 59.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -174.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.23 14.46 3.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.604 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 27.0 t30 -62.58 115.07 14.29 Favored Pre-proline 0 C--N 1.33 -0.253 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 170.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.504 ' HA ' HD11 ' A' ' 54' ' ' LEU . 29.0 Cg_exo -62.66 -0.42 1.95 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.402 2.734 . . . . 0.0 114.281 -171.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -112.26 1.63 16.22 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.318 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.604 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 92.2 m-20 -66.74 128.7 93.98 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 10.0 Cg_exo -70.61 142.44 44.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.845 2.363 . . . . 0.0 111.285 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.437 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 47.8 ttp180 -64.81 110.95 2.58 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.88 2.61 6.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.688 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 58.7 m -75.28 118.12 17.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.548 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.4 p90 -124.57 161.31 26.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.123 0.487 . . . . 0.0 112.117 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.636 ' HB2' ' HD2' ' A' ' 7' ' ' PHE . 1.8 pt? -161.44 138.88 8.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 0.0 108.979 170.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.495 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.6 p -106.51 125.64 62.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.679 0.752 . . . . 0.0 111.09 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 24.8 ptt85 -116.15 150.01 38.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.317 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -88.31 127.22 35.47 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.1 m -79.9 110.26 15.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.13 0.49 . . . . 0.0 110.985 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -25.06 61.32 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.6 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.86 -3.77 58.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.689 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.5 m -155.0 94.75 1.67 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.576 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -84.84 38.75 0.72 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.716 0.769 . . . . 0.0 110.993 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.01 12.91 4.73 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.186 -1.165 . . . . 0.0 110.186 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.567 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -163.0 142.13 8.66 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.936 -0.632 . . . . 0.0 110.382 -175.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 50.8 m-85 -109.15 179.3 4.2 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 173.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -134.42 109.08 8.52 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.228 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -90.25 87.51 6.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.4 m -80.69 119.96 23.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.625 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.67 139.79 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.035 0.445 . . . . 0.0 110.265 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.7 t -83.49 119.64 24.93 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 121.722 0.772 . . . . 0.0 110.384 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.437 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 12.7 t70 -106.47 145.64 31.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.282 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.539 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 77.9 t80 -123.32 124.75 43.67 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.644 -173.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -111.89 140.74 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.221 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.508 HD22 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -82.62 -11.08 58.65 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -172.313 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.508 ' N ' HD22 ' A' ' 50' ' ' ASN . . . -113.51 -35.82 5.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.739 0.304 . . . . 0.0 111.136 -179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -87.5 -51.64 5.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.318 0.58 . . . . 0.0 110.32 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 131.83 -150.97 19.66 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -174.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.539 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.2 mp -90.54 139.31 30.81 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -125.73 130.37 51.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.2 t -93.25 112.68 26.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 121.23 0.538 . . . . 0.0 111.003 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -93.47 113.11 25.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.597 177.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.5 88.67 6.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.254 -176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 84.9 m-85 -75.79 112.79 12.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -81.93 122.9 28.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.401 -177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 71' ' ' ILE . 58.8 mt -92.07 92.09 3.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.138 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -75.01 146.01 41.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.262 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HB2' ' NZ ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -107.19 156.08 19.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.302 0.572 . . . . 0.0 111.631 -178.088 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.8 mt -95.08 149.87 20.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 165.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.68 -61.45 2.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.936 0.398 . . . . 0.0 111.28 -175.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.0 m -117.79 35.23 4.79 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.38 -107.25 2.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.02 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.86 -170.42 17.24 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.325 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.475 ' HB3' HG22 ' A' ' 61' ' ' ILE . 82.2 m-85 -101.82 138.43 38.81 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.65 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 52.4 p90 -143.93 135.31 25.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.214 0.53 . . . . 0.0 110.786 -178.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 61' ' ' ILE . 63.8 mt -82.9 -34.32 11.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.495 0.665 . . . . 0.0 109.373 174.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.5 t -126.95 154.77 44.11 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.647 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.1 m -77.88 56.01 1.49 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.164 0.507 . . . . 0.0 111.311 -175.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 74' ' ' ARG . 46.9 mtp180 -139.82 -71.6 0.38 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.656 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -105.28 104.81 14.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.207 -175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -111.7 154.58 24.76 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -136.89 137.6 39.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.912 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.8 p -69.62 -12.55 61.73 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.8 p -134.97 144.37 47.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.07 0.462 . . . . 0.0 110.061 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.0 mt -66.81 -21.74 66.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.578 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -59.52 -49.58 77.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.213 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -73.69 -26.54 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.628 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -57.29 -61.7 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.143 177.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.55 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -66.01 -44.33 92.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.599 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.79 -39.49 58.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.068 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -84.29 -40.85 17.48 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.062 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.642 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.3 m-30 -73.0 -7.87 53.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.894 0.378 . . . . 0.0 111.946 -176.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.524 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.3 m -86.1 2.33 47.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.346 0.593 . . . . 0.0 109.846 172.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -131.66 -38.32 1.16 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.48 -176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.642 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 74.8 m-70 -133.97 111.8 10.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.578 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -74.47 -35.15 63.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -173.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.7 t0 62.19 -82.41 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.891 0.744 . . . . 0.0 111.258 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -86.15 -37.5 9.07 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.837 -176.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.603 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -69.82 147.26 50.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.98 0.419 . . . . 0.0 110.913 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 70.2 m -73.22 -14.36 61.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.003 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -136.55 131.19 33.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.028 -177.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -64.68 133.97 53.27 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 172.731 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.548 HD22 ' CG ' ' A' ' 29' ' ' PHE . 81.1 mt -56.37 107.3 0.36 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.389 -176.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.6 m -96.64 -60.86 1.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.937 -172.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.432 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.6 p30 -131.89 149.47 52.43 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.19 143.53 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 54.0 t -50.71 120.45 13.14 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.63 -174.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.0 Cg_exo -71.33 130.77 17.92 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.969 2.446 . . . . 0.0 111.396 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.322 -0.627 0 CA-C-O 121.397 0.617 . . . . 0.0 110.892 179.747 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.55 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 67.1 mm-40 . . . . . 0 N--CA 1.456 -0.152 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' HG11 ' A' ' 101' ' ' VAL . 34.7 mt-10 -58.8 -27.53 65.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.1 -174.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.629 ' HA ' HG11 ' A' ' 101' ' ' VAL . 6.6 p-90 -104.91 -32.21 8.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.073 -175.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.558 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 58.8 t80 -90.29 111.02 22.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.796 -174.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -106.68 25.42 11.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.537 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 72.57 -150.37 44.85 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.529 -0.629 . . . . 0.0 111.529 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.8 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 15.9 pttm -107.87 71.04 0.79 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.469 0.652 . . . . 0.0 110.589 175.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 pt -73.65 149.27 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.168 172.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -77.86 167.1 22.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.231 -176.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -58.48 -44.1 89.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.82 -0.173 . . . . 0.0 110.81 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 15.9 mmm180 -53.46 -45.12 69.41 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 123.355 0.409 . . . . 0.0 110.753 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -66.17 -50.38 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.673 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.524 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 18.0 t -60.65 -51.5 69.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.356 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.599 ' HB3' HD23 ' A' ' 20' ' ' LEU . 68.9 mt-10 -77.21 -20.03 55.89 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.633 -174.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 46.4 ttp180 -61.71 -36.07 79.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.43 0.634 . . . . 0.0 109.329 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.5 mt -81.87 -44.14 17.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.034 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.582 HD21 HD22 ' A' ' 30' ' ' LEU . 78.4 mt -72.38 -28.77 63.22 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -173.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.3 mm? -82.88 19.67 1.32 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.958 0.408 . . . . 0.0 111.365 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.7 t-20 -99.59 119.69 59.42 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.2 Cg_exo -65.02 1.47 1.89 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.584 2.856 . . . . 0.0 114.521 -172.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -76.95 -16.88 59.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.409 . . . . 0.0 110.263 175.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -94.42 124.4 55.53 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.03 171.17 14.41 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.078 2.518 . . . . 0.0 112.765 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -58.88 109.66 0.87 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.62 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.43 -2.09 6.57 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.309 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 50.5 m -74.41 111.23 9.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.737 0.303 . . . . 0.0 110.327 176.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 34.5 p90 -127.26 166.39 17.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.99 0.424 . . . . 0.0 111.454 -175.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.582 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -162.32 145.27 11.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 170.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.486 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.8 p -107.87 123.78 63.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.793 0.806 . . . . 0.0 111.107 -176.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 30.4 ptt85 -126.92 138.14 53.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.348 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.8 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 7.7 tp10 -66.55 141.53 57.82 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.793 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 50.0 m -71.75 127.68 33.34 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.059 0.456 . . . . 0.0 110.023 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.625 ' HG2' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -58.43 -26.84 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.732 -175.346 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.625 HG23 ' HG2' ' A' ' 35' ' ' GLU . 17.2 p -118.66 24.21 11.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.818 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.793 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 7.3 m -141.03 137.19 32.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.869 0.366 . . . . 0.0 110.381 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -102.66 94.72 5.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.967 0.413 . . . . 0.0 110.705 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.76 50.83 2.06 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.352 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -159.19 99.3 1.48 Allowed 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 177.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.444 ' CE1' ' HE1' ' A' ' 6' ' ' TYR . 85.5 m-85 -89.92 139.41 30.62 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.705 -169.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 91.4 m -95.93 98.4 10.37 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.882 177.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.486 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.0 tm? -73.37 92.99 1.88 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 174.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 13.9 m -88.45 99.02 11.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.132 -174.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.9 p -101.97 125.38 56.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.257 0.551 . . . . 0.0 110.519 178.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.572 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 46.8 t -82.49 130.28 35.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.819 177.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.487 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 29.7 t70 -113.98 126.99 55.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.713 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -96.72 97.39 9.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.615 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -101.95 148.56 25.2 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.451 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -82.3 -20.79 36.73 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.246 -173.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -110.95 -46.33 3.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.959 0.409 . . . . 0.0 110.98 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -85.01 -15.34 44.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.201 -177.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.21 -156.61 35.91 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.825 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 22' ' ' PRO . 49.7 mt -76.95 106.29 8.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.546 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -119.56 125.38 48.67 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.711 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.14 120.02 37.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.441 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.487 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 55.3 mttm -93.59 103.03 15.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -83.37 90.05 7.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.189 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.484 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 71.7 m-85 -76.33 129.99 37.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.59 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -93.9 109.29 21.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.382 0.611 . . . . 0.0 110.844 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.484 HG12 HG12 ' A' ' 71' ' ' ILE . 68.1 mt -84.67 112.21 21.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.654 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -103.54 164.57 11.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.396 -177.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -118.08 133.7 55.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.082 0.467 . . . . 0.0 111.241 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.508 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 83.4 mt -88.06 136.76 32.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.951 175.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.67 -20.3 65.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.877 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.3 m -128.54 42.78 3.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.323 0.582 . . . . 0.0 110.627 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -168.39 -99.07 0.13 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.228 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -174.41 -147.99 6.37 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.621 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -88.14 142.5 27.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.713 0.292 . . . . 0.0 110.243 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.508 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 18.3 p90 -149.1 134.02 18.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.268 0.556 . . . . 0.0 111.049 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.578 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 70.3 mt -87.81 -26.71 5.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 169.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.3 t -146.5 152.86 39.67 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.925 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.8 m -82.19 56.24 3.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.915 0.388 . . . . 0.0 111.652 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -130.4 -54.75 1.1 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.999 0.428 . . . . 0.0 110.786 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -122.06 106.8 11.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' HD12 ' A' ' 64' ' ' LEU . 20.4 mp0 -99.58 146.37 26.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.656 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 82' ' ' GLN . 74.3 m-85 -136.98 135.98 38.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.991 0.424 . . . . 0.0 110.794 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.1 p -78.54 -27.12 45.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.089 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.458 ' HB2' ' HG3' ' A' ' 82' ' ' GLN . 4.3 m -110.47 135.79 50.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.478 . . . . 0.0 109.74 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.564 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.7 mt -65.74 -26.56 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.13 -178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -57.42 -40.83 79.17 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.23 0.538 . . . . 0.0 110.337 174.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.461 ' HB2' ' HB3' ' A' ' 77' ' ' PHE . 40.0 mt-30 -71.0 -36.56 72.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.034 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.426 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -58.06 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.711 -178.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -64.23 -42.52 95.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.076 -176.679 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.15 -50.3 71.53 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -72.89 -40.48 65.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 0.0 111.013 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.591 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.4 m-30 -75.7 -1.23 23.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.194 0.521 . . . . 0.0 111.331 -178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.8 t -75.55 -32.73 60.53 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.153 0.501 . . . . 0.0 109.768 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -105.46 -42.2 5.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.615 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.6 t-80 -101.3 100.75 11.3 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.73 74.32 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.362 0.414 . . . . 0.0 110.645 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.429 ' HB3' ' H ' ' A' ' 93' ' ' GLY . 1.6 t0 63.61 -86.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.568 172.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.429 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -103.47 -27.47 6.43 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.249 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.1 mp -70.64 145.52 50.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 110.521 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 40.8 t -68.76 -24.52 64.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.305 176.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -136.09 136.56 40.25 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.433 ' H ' ' CD ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -72.69 145.17 47.38 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.677 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.511 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -62.94 102.73 0.38 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.403 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.6 m -87.55 -67.08 0.85 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.851 -172.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.0 p-10 -135.94 144.32 45.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.132 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.629 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -90.0 145.06 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.8 t -73.47 132.9 80.88 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.243 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -88.12 173.06 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.027 2.484 . . . . 0.0 111.694 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 15.0 p . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 121.076 0.465 . . . . 0.0 111.038 179.916 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.8 -43.69 62.44 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.558 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 27.1 p-90 -66.25 -43.15 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -172.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG13 ' A' ' 31' ' ' VAL . 38.7 t80 -85.54 96.6 9.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.008 0.433 . . . . 0.0 110.502 -178.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -76.21 -62.68 1.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.342 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 138.36 -163.41 25.73 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -177.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.625 ' HB3' ' HB2' ' A' ' 33' ' ' GLU . 8.2 pttm -83.25 62.22 6.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 111.622 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 pt -78.03 132.33 32.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 169.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.3 p -74.68 177.56 6.04 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.815 -0.175 . . . . 0.0 111.399 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -58.79 -49.8 76.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -55.66 -36.01 66.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.361 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.645 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 35.9 mt-10 -78.4 -53.42 7.28 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.887 -177.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.1 p -62.21 -46.75 87.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.914 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.76 -48.52 76.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.085 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -59.11 -27.67 65.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.407 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 82.6 mt -71.88 -39.93 69.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 0.0 110.777 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.561 HD12 HG13 ' A' ' 56' ' ' VAL . 50.2 mt -87.55 -18.09 30.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.581 -175.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.2 mm? -77.73 8.01 5.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.124 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 23' ' ' GLU . 21.1 t-20 -91.19 113.0 56.84 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.529 ' HA ' HD11 ' A' ' 54' ' ' LEU . 60.5 Cg_endo -73.57 9.52 1.53 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.07 2.513 . . . . 0.0 113.501 -173.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.448 ' HB2' ' OD1' ' A' ' 21' ' ' ASN . 29.3 mt-10 -93.0 -10.28 36.82 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.498 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 91.3 m-20 -92.12 133.8 29.64 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.636 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 22.5 Cg_exo -65.39 160.89 40.4 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.183 2.589 . . . . 0.0 112.951 -177.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.694 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 57.3 ttp180 -72.15 120.19 17.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.754 175.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.64 6.21 25.24 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.837 -176.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 87.7 m -73.06 117.21 14.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CZ ' HG22 ' A' ' 101' ' ' VAL . 28.2 p90 -121.19 161.5 21.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.992 0.425 . . . . 0.0 111.923 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -166.16 135.02 3.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.127 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -99.49 125.3 53.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.602 0.715 . . . . 0.0 110.704 -178.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.592 ' CG ' ' HB2' ' A' ' 42' ' ' CYS . 5.4 ptm180 -112.3 148.19 34.72 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.939 -176.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.625 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 46.7 mt-10 -67.32 120.08 13.24 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 170.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.2 t -75.08 74.82 2.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 57.1 33.53 23.47 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.357 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.525 ' OG1' ' HD3' ' A' ' 9' ' ' LYS . 3.1 m 54.5 38.18 29.23 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.808 -176.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.1 m -79.16 103.85 9.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -61.51 124.06 19.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.919 0.39 . . . . 0.0 110.124 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.458 ' O ' ' HD2' ' A' ' 62' ' ' ARG . . . 106.89 -5.49 36.78 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.118 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -143.3 108.15 4.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.178 0.513 . . . . 0.0 111.254 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -118.5 139.66 51.09 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.592 ' HB2' ' CG ' ' A' ' 32' ' ' ARG . 35.7 m -97.63 104.56 16.59 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.052 -176.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.47 97.16 7.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 t -93.63 134.72 35.64 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.113 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 p -133.13 141.36 44.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.517 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 p -78.34 115.23 17.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.251 0.548 . . . . 0.0 111.074 -178.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.674 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 10.5 t70 -95.37 139.18 32.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.978 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.694 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 94.1 t80 -109.86 130.13 55.56 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.075 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -124.08 143.99 50.13 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -88.98 -8.37 54.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.148 0.499 . . . . 0.0 110.84 -172.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.15 -45.15 3.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.572 177.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -86.6 -37.09 18.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.434 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 114.93 -90.5 0.53 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.779 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.529 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.3 mt -130.19 147.62 51.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.021 0.438 . . . . 0.0 111.331 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -134.68 149.54 50.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.109 174.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.561 HG13 HD12 ' A' ' 19' ' ' LEU . 39.0 t -107.75 114.8 47.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.968 0.413 . . . . 0.0 110.471 178.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.674 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 67.0 mttm -95.42 108.18 20.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.356 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -88.7 88.86 7.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.92 0.391 . . . . 0.0 110.696 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -78.09 92.17 4.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.34 126.84 30.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.62 0.724 . . . . 0.0 110.932 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 71' ' ' ILE . 70.1 mt -96.12 127.61 48.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.909 -176.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 39' ' ' GLY . 24.2 tpt180 -99.31 140.86 32.87 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 28.1 ttpp -87.34 127.56 35.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' H ' ' A' ' 66' ' ' SER . 21.6 tp -75.53 125.93 30.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.556 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -60.8 -29.43 69.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.354 0.597 . . . . 0.0 109.891 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.507 ' H ' ' HG ' ' A' ' 64' ' ' LEU . 4.9 m -85.05 -45.42 12.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.998 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.425 ' H ' ' CG ' ' A' ' 64' ' ' LEU . . . -118.77 -109.1 2.37 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.118 -1.039 . . . . 0.0 113.154 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -130.46 -101.1 0.9 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.177 -173.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -133.07 150.4 52.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.645 0.259 . . . . 0.0 110.889 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -161.23 140.2 10.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.237 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 61' ' ' ILE . 55.9 mt -85.08 -27.99 6.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.36 0.6 . . . . 0.0 110.071 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 74' ' ' ARG . 4.4 t -151.06 150.86 31.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.86 -178.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.8 m -78.32 58.89 2.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.25 0.548 . . . . 0.0 111.504 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.669 ' HG2' HG23 ' A' ' 72' ' ' THR . 15.8 ptp180 -142.47 -28.71 0.59 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.936 175.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 36.9 m -139.2 124.49 19.12 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.549 177.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -126.23 144.53 50.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.741 -174.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.508 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 75.0 m-85 -130.96 179.53 5.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.744 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.41 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 14.3 m -95.13 -38.74 10.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.572 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 83.4 p -122.89 166.95 14.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.999 0.428 . . . . 0.0 110.666 -177.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.626 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.1 mt -77.62 -17.1 58.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.993 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -48.03 64.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.312 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -61.04 -37.75 83.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.788 176.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.651 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -54.13 -66.55 0.38 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.089 . . . . 0.0 110.709 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -61.34 -43.33 96.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -176.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.51 -42.17 77.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.988 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -82.32 -40.09 21.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.162 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.0 m-85 -74.63 -4.62 38.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.112 0.482 . . . . 0.0 111.194 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.3 t -76.91 -26.46 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.544 0.687 . . . . 0.0 109.427 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -101.88 -47.63 4.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.796 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 10.6 t-80 -113.14 109.63 19.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.795 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.62 88.85 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.339 0.399 . . . . 0.0 110.8 -177.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.422 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 37.6 t70 67.52 -78.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.089 0.868 . . . . 0.0 112.5 169.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -106.14 -37.18 2.55 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.933 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.62 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.14 145.81 54.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.3 0.571 . . . . 0.0 110.966 178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.23 -19.25 59.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.079 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -127.81 125.4 39.73 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 97' ' ' ARG . 7.2 ptp180 -69.75 153.12 43.81 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.477 HD22 ' CG ' ' A' ' 29' ' ' PHE . 63.4 mt -74.45 94.82 2.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.01 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.2 p -89.12 -78.2 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.725 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -111.07 145.25 38.85 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.544 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -88.37 138.06 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.4 t -55.73 124.4 56.87 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.397 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.52 133.35 23.99 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.068 1.846 . . . . 0.0 110.927 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.152 0.501 . . . . 0.0 109.796 177.608 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 110.486 -0.19 . . . . 0.0 110.486 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -47.75 -53.17 16.03 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -170.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.5 p-90 -64.9 -40.9 95.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.489 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -85.48 85.51 7.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.102 0.477 . . . . 0.0 110.218 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 6.9 m-85 -67.75 -13.59 62.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.663 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 99.84 -148.03 18.4 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.983 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -95.79 50.52 1.21 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 0.0 110.801 -175.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.3 pt -75.02 147.31 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.7 p -73.85 157.32 36.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.074 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -56.9 -35.3 68.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.984 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 30.3 ttp180 -50.58 -57.18 8.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.874 174.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 27.4 mt-10 -68.61 -45.04 73.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.972 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.2 t -53.7 -58.58 6.68 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.708 -175.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.683 ' HB2' HG11 ' A' ' 56' ' ' VAL . 2.2 pt-20 -73.97 -36.02 64.54 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.456 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -56.73 -38.27 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.724 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 94.2 mt -63.65 -39.18 93.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.666 176.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.512 HD12 HG13 ' A' ' 56' ' ' VAL . 30.4 mt -77.25 -15.75 59.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.152 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.564 HD22 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -76.71 -4.42 43.19 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 122.231 -0.293 . . . . 0.0 111.6 175.691 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -73.87 110.66 9.68 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -57.21 -14.52 15.51 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.487 2.791 . . . . 0.0 113.998 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.49 -10.67 59.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 1.2 p30 -98.89 138.49 20.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 178.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 83.2 Cg_endo -88.09 173.15 5.0 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 123.198 2.599 . . . . 0.0 113.566 -176.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.432 ' HD3' ' ND1' ' A' ' 96' ' ' HIS . 26.1 ttm180 -68.5 128.35 36.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.747 176.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -5.0 22.36 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.562 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.63 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 33.0 m -73.34 130.36 40.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CG ' HD22 ' A' ' 98' ' ' LEU . 42.1 p90 -141.63 161.54 37.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.795 0.331 . . . . 0.0 111.501 -176.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.7 pt? -159.67 143.9 14.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.551 173.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -111.96 121.08 63.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.458 0.647 . . . . 0.0 110.801 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 32' ' ' ARG . 22.9 ptt85 -108.65 143.16 38.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.928 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -78.5 100.87 7.07 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.63 176.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -80.62 76.6 7.48 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -5.2 6.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.958 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -69.38 -26.57 64.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.283 0.563 . . . . 0.0 109.767 171.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.0 m -139.22 92.18 2.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.423 176.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -60.83 120.81 10.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.999 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 107.43 -6.27 36.07 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.196 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -114.49 95.61 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.323 0.582 . . . . 0.0 110.565 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.748 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.7 m-85 -87.07 148.97 25.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.904 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 59.3 m -109.39 106.12 15.78 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.665 -178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.709 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.4 tm? -86.82 90.48 8.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 174.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.3 t -81.89 129.73 34.85 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.463 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.25 143.18 41.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 120.932 0.396 . . . . 0.0 110.676 -176.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -83.44 113.82 21.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.114 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.592 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 8.2 t70 -93.92 142.58 27.22 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -126.51 118.1 24.22 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.958 0.409 . . . . 0.0 110.54 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -129.2 144.01 51.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.868 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -89.45 31.72 0.9 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.947 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -137.26 -49.57 0.61 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.304 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -99.16 -8.32 25.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.157 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.51 -134.92 12.87 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.232 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.1 mp -88.26 131.03 34.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.797 0.332 . . . . 0.0 110.59 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.592 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 30.8 m-80 -119.94 130.65 54.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.683 HG11 ' HB2' ' A' ' 16' ' ' GLU . 84.8 t -102.32 116.43 45.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.294 0.569 . . . . 0.0 111.022 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -109.62 116.99 32.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.331 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -89.07 99.79 12.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.878 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB3' HG23 ' A' ' 71' ' ' ILE . 31.3 m-85 -79.49 155.19 28.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.21 0.529 . . . . 0.0 111.424 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 1.9 mtmt -98.25 107.84 20.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.18 -169.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 71' ' ' ILE . 35.7 mt -99.01 75.71 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -98.28 133.64 42.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.462 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 27.8 ttmt -71.96 139.42 48.66 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.888 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.25 147.92 51.54 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 169.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -45.47 -47.3 14.0 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.639 0.587 . . . . 0.0 111.375 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.0 m -139.86 48.4 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.971 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -134.06 -107.34 0.97 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.354 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -151.24 -170.66 18.43 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.786 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 95.6 m-85 -91.01 141.23 29.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.695 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 53.5 p90 -145.11 143.57 30.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.648 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 61' ' ' ILE . 54.4 mt -90.95 -21.82 6.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 122.014 0.911 . . . . 0.0 108.934 172.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.659 HG21 ' HB3' ' A' ' 92' ' ' ASP . 4.2 t -149.29 153.49 37.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.541 -1.209 . . . . 0.0 109.13 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 m -78.37 46.79 0.65 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 111.828 -174.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -131.13 -67.03 0.72 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.275 0.56 . . . . 0.0 109.592 178.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.1 m -103.95 148.96 25.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.534 177.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.7 pt20 -159.48 148.69 18.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.599 0.237 . . . . 0.0 110.92 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -137.38 149.97 47.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 111.033 -176.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.8 t -82.69 -15.12 53.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.869 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.6 m -128.32 141.58 51.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.7 mt -67.6 -27.51 66.97 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.483 -173.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -66.82 -46.66 74.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.36 -30.68 71.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.654 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -54.03 -68.04 0.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.866 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -61.98 -42.64 95.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.889 -177.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.21 -47.2 72.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.082 -179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -81.0 -33.66 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.421 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 26.5 m-85 -70.85 -7.35 44.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.955 0.407 . . . . 0.0 111.465 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.1 m -79.86 -16.85 54.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.661 171.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -109.4 -27.36 9.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.33 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 0.1 OUTLIER -131.42 105.23 7.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.751 -176.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.4 ' HB2' ' HB3' ' A' ' 97' ' ' ARG . . . -72.48 -41.18 66.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.792 0.33 . . . . 0.0 110.864 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.659 ' HB3' HG21 ' A' ' 72' ' ' THR . 0.8 OUTLIER 59.89 -87.43 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.797 176.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -95.12 -30.57 8.19 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.112 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.625 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -68.96 141.49 54.94 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.148 177.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.1 -17.3 62.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.628 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.432 ' ND1' ' HD3' ' A' ' 26' ' ' ARG . 80.6 m-70 -137.26 130.28 30.65 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 91' ' ' ALA . 16.8 ptp180 -71.65 148.98 45.98 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.559 HD22 ' CG ' ' A' ' 29' ' ' PHE . 54.0 mt -62.39 120.09 10.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.546 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.5 m -111.43 -60.68 1.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.081 0.467 . . . . 0.0 110.933 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.63 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.9 p-10 -133.25 141.63 48.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.686 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.401 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -79.9 149.89 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -177.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.5 t -55.15 121.58 37.36 Favored Pre-proline 0 C--N 1.328 -0.349 0 O-C-N 123.645 0.591 . . . . 0.0 110.775 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -83.54 138.12 8.31 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.54 2.16 . . . . 0.0 111.515 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--N 1.323 -0.549 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.675 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -53.92 -34.61 60.07 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -166.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.6 p-90 -82.33 -35.86 27.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.491 ' CE2' ' HA2' ' A' ' 8' ' ' GLY . 64.9 t80 -87.22 109.29 19.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.967 0.413 . . . . 0.0 110.721 -177.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.613 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 40.0 m-85 -96.86 19.85 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.224 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.491 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 65.55 -141.53 42.57 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.357 177.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.616 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 58.8 mtmt -107.35 87.82 2.59 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.178 0.513 . . . . 0.0 110.848 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.8 pt -103.19 155.7 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.305 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 p -84.94 174.77 9.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 12' ' ' ARG . 18.6 mtm180 -59.67 -48.44 81.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.103 -177.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -54.96 -43.13 73.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.015 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.08 -52.25 66.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.003 0.43 . . . . 0.0 110.669 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -67.35 -47.98 68.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.143 -176.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.64 -42.08 87.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.57 -175.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -55.72 -41.47 73.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.075 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.85 -44.32 55.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.336 -177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD11 ' CD2' ' A' ' 30' ' ' LEU . 79.0 mt -78.4 -26.35 46.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -172.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' A' ' 20' ' ' LEU . 4.0 mm? -81.2 3.85 22.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 111.448 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.46 ' C ' ' H ' ' A' ' 23' ' ' GLU . 94.3 m-20 -73.99 138.02 76.1 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.85 30.37 0.29 Allowed 'Trans proline' 0 N--CA 1.472 0.222 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 21' ' ' ASN . 33.5 mt-10 -121.37 7.47 10.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.72 -178.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 48.7 m-80 -107.54 115.06 59.94 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.569 -178.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 52.1 Cg_endo -69.04 145.8 62.52 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.462 2.108 . . . . 0.0 110.444 170.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.692 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 55.2 ttp180 -60.71 114.67 3.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.25 6.15 7.64 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.35 -172.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.792 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 94.2 m -84.27 112.47 20.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.75 0.31 . . . . 0.0 110.316 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 33.5 p90 -117.09 158.28 24.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.055 0.455 . . . . 0.0 112.114 -171.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.613 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.8 pt? -154.02 138.05 16.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 170.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.61 118.26 55.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.446 0.641 . . . . 0.0 110.869 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -111.13 149.39 30.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.825 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 44.1 tt0 -92.43 130.5 38.09 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -107.51 98.54 8.14 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -72.21 -1.99 17.15 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.378 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.8 p -64.92 -19.48 65.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.601 0.715 . . . . 0.0 109.756 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.79 159.91 22.25 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.082 176.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -80.17 71.9 6.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.124 0.488 . . . . 0.0 110.811 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.37 32.23 12.32 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.843 176.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.67 141.17 30.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.92 0.391 . . . . 0.0 110.18 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.0 m-85 -117.3 165.4 13.51 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.54 -175.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.0 m -127.66 108.58 10.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.135 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.597 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.5 tm? -89.95 90.57 8.22 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.0 m -89.11 123.29 33.25 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.473 ' CG1' ' HB2' ' A' ' 57' ' ' LYS . 14.3 p -112.22 130.31 66.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.229 177.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 28' ' ' THR . 46.8 t -68.03 121.69 16.64 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.692 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 16.5 t70 -122.15 154.5 37.33 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.741 -170.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -135.87 95.8 3.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.502 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.51 118.18 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -75.1 60.53 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.66 0.743 . . . . 0.0 109.765 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.08 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.433 -1.258 . . . . 0.0 108.705 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -108.3 -63.7 1.3 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.81 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.74 -151.86 21.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.875 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.2 128.38 35.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.254 -178.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -151.59 177.53 10.25 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.21 119.95 59.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.664 0.269 . . . . 0.0 110.885 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 52.8 mttp -87.24 103.94 15.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -84.75 86.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.277 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.6 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 45.7 m-85 -72.41 127.77 33.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.178 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.406 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 23.7 pttm -83.39 124.84 31.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.042 0.449 . . . . 0.0 111.403 -176.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 71' ' ' ILE . 57.3 mt -102.25 106.33 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.676 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.439 ' HD2' HH11 ' A' ' 62' ' ' ARG . 11.4 mmt85 -108.81 172.18 6.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.224 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 51.9 mtmt -123.9 157.74 33.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.197 0.522 . . . . 0.0 111.659 -177.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.42 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 60.1 mt -123.51 151.09 43.17 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.724 178.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.33 -64.71 0.74 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 111.145 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 65.8 m -103.1 22.46 13.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.118 0.485 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 64' ' ' LEU . . . -112.97 -97.02 2.28 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.644 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.554 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 158.79 -149.69 19.92 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.61 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -80.75 126.6 31.51 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.5 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 30.3 p90 -140.48 141.15 35.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.249 0.547 . . . . 0.0 110.271 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 61' ' ' ILE . 23.9 mt -101.84 -6.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 122.31 1.053 . . . . 0.0 108.546 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.938 HG21 ' HA3' ' A' ' 93' ' ' GLY . 2.5 t -169.5 160.01 8.86 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.649 -173.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.2 p -74.12 0.38 14.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.757 0.313 . . . . 0.0 111.011 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -67.82 -54.73 16.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.443 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m -142.25 141.35 32.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.872 -174.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.5 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 24.7 mp0 -125.19 138.1 54.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.93 178.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -130.75 140.74 50.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 0.0 111.191 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.7 p -82.22 -8.63 59.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.332 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 24.7 m -131.23 132.73 44.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.032 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.561 ' O ' HG22 ' A' ' 84' ' ' VAL . 53.4 mt -64.65 -30.32 71.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.871 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.72 -46.15 84.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.329 175.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 7.9 mm-40 -77.0 -21.25 54.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -178.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.496 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -62.59 -59.69 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.509 174.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.93 -42.03 88.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.945 -178.215 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.0 -22.09 62.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -91.73 -48.88 6.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.739 0.304 . . . . 0.0 110.591 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.722 ' HD2' ' HG ' ' A' ' 94' ' ' LEU . 7.0 m-85 -73.13 -5.47 39.32 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.789 -176.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.9 p -78.67 -33.0 47.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.261 0.553 . . . . 0.0 110.244 173.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -95.8 -51.65 4.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.141 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.408 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 4.7 t-80 -120.89 107.27 12.49 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.323 177.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -62.58 -37.5 86.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.479 -176.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.41 -72.27 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.193 172.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.938 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -104.01 -22.68 8.63 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.722 ' HG ' ' HD2' ' A' ' 87' ' ' TYR . 15.4 mt -79.42 155.5 28.32 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 35.4 t -82.39 -29.18 30.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.34 0.59 . . . . 0.0 109.937 177.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -127.34 125.62 41.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.36 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -72.41 137.72 46.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.016 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.592 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 59.6 mt -61.42 100.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.791 -174.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -97.73 -53.38 3.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.697 -173.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.792 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 t30 -127.08 136.07 51.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.965 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -87.01 148.31 4.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.862 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.2 t -50.73 125.21 21.25 Favored Pre-proline 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 111.659 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -69.73 144.87 55.61 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.021 2.481 . . . . 0.0 111.749 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--N 1.318 -0.768 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.107 178.756 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 N--CA 1.452 -0.363 0 CA-C-O 120.437 0.161 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.453 ' O ' HG11 ' A' ' 101' ' ' VAL . 50.1 mt-10 -57.11 -40.77 77.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.045 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.624 ' HA ' HG11 ' A' ' 101' ' ' VAL . 4.6 p-90 -84.19 -41.62 16.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.508 ' HE1' ' HA2' ' A' ' 8' ' ' GLY . 2.6 t80 -85.41 104.36 15.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.665 -174.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -94.68 -2.66 50.82 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.508 ' HA2' ' HE1' ' A' ' 6' ' ' TYR . . . 79.14 -169.31 53.9 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.795 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 51.9 pttt -67.1 98.75 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 110.982 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.1 pt -125.66 141.58 45.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.486 172.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.2 p -73.73 152.37 40.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.258 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -60.01 -34.94 74.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.016 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.631 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 11.5 ptm180 -55.03 -41.88 71.91 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.334 0.396 . . . . 0.0 111.007 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HG2' ' HG3' ' A' ' 13' ' ' ARG . 4.9 mm-40 -82.17 -47.61 12.3 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 33.3 t -59.17 -49.3 78.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.674 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB2' HG11 ' A' ' 56' ' ' VAL . 3.9 pt-20 -79.9 -31.49 40.21 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.23 -174.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.631 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 24.0 ttm180 -58.13 -36.53 73.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 174.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 71.0 mt -60.48 -44.77 95.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.976 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.521 HD12 HG13 ' A' ' 56' ' ' VAL . 44.7 mt -74.79 -22.92 58.48 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.779 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.458 HD22 HG23 ' A' ' 56' ' ' VAL . 2.1 mm? -74.03 -7.95 54.33 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.419 175.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.425 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 94.0 m-20 -80.42 119.95 77.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HA ' HD11 ' A' ' 54' ' ' LEU . 13.1 Cg_exo -70.35 44.61 0.47 Allowed 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.484 2.789 . . . . 0.0 113.156 -177.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -115.39 -0.46 13.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.948 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -123.09 145.42 45.98 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.152 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -87.62 172.06 5.87 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.954 2.436 . . . . 0.0 112.439 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -64.15 125.73 25.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.927 177.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.54 12.14 21.84 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.327 -0.94 . . . . 0.0 112.126 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.54 ' HB ' ' OG ' ' A' ' 46' ' ' SER . 32.6 m -81.75 116.31 21.39 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 173.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.469 ' CG ' HD22 ' A' ' 98' ' ' LEU . 38.2 p90 -121.9 168.61 11.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.769 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.71 127.96 3.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 171.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.499 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -91.34 109.61 21.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.023 0.916 . . . . 0.0 110.088 177.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.482 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 18.7 ptt180 -109.49 153.98 23.3 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.587 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.61 152.48 24.8 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.748 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 3.0 p -59.8 125.66 24.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.89 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.07 -53.27 7.59 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.738 -175.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.9 p -108.88 -11.42 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.219 0.533 . . . . 0.0 110.474 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.748 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 6.0 m -91.61 158.93 16.14 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.514 -0.767 . . . . 0.0 108.958 175.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -118.41 80.28 1.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.143 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.11 54.51 0.52 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.389 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.84 88.84 1.13 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.158 0.504 . . . . 0.0 109.868 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.615 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 64.6 m-85 -64.0 141.22 58.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.077 -175.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.482 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 48.5 t -109.22 107.08 17.21 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.142 0.496 . . . . 0.0 110.576 -177.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -86.93 87.58 7.49 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t -87.06 132.2 33.88 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.6 p -126.46 140.15 49.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.874 0.368 . . . . 0.0 110.23 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.54 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 97.8 p -88.28 139.54 30.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.144 -178.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -123.87 126.87 47.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.325 0.583 . . . . 0.0 110.28 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -106.91 89.19 2.93 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.686 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.84 152.14 20.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.287 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -100.16 10.42 41.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.043 -174.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.01 -42.28 2.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.023 0.439 . . . . 0.0 110.425 176.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.54 -36.01 10.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.592 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 106.59 -156.77 16.05 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.967 -0.635 . . . . 0.0 111.57 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.438 HD11 ' HA ' ' A' ' 22' ' ' PRO . 20.7 mt -69.9 124.46 24.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.882 0.372 . . . . 0.0 110.965 177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -136.56 146.41 46.12 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.521 HG13 HD12 ' A' ' 19' ' ' LEU . 86.4 t -109.51 127.83 66.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.29 0.567 . . . . 0.0 111.217 -175.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -107.65 98.9 8.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.085 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -79.15 95.99 5.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.228 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.533 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 69.5 m-85 -84.8 148.29 26.4 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -114.31 122.05 45.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.092 0.473 . . . . 0.0 111.562 -173.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.615 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 83.5 mt -89.47 93.89 4.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.309 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 ttp85 -96.21 156.29 16.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -74.6 146.13 42.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.419 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.715 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 1.4 tt -53.79 -60.5 3.23 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.689 0.757 . . . . 0.0 109.884 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.5 t70 174.12 -30.29 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 113.477 -1.692 . . . . 0.0 107.582 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -125.39 -62.33 1.21 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.67 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.39 67.5 0.25 Allowed Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.951 -1.119 . . . . 0.0 113.265 -176.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -150.59 140.85 8.22 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -109.24 133.1 53.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.216 0.508 . . . . 0.0 110.098 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.715 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 53.6 p90 -148.03 149.07 31.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.523 HG12 HG12 ' A' ' 61' ' ' ILE . 58.3 mt -95.98 -20.89 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.978 0.894 . . . . 0.0 109.156 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -148.61 147.75 29.33 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.911 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m -76.12 55.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -138.49 -35.54 0.6 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -126.01 120.41 30.22 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.16 -0.216 . . . . 0.0 110.522 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -114.78 136.74 52.75 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -124.06 153.78 40.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.409 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.6 m -92.46 -19.4 22.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.091 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.2 p -131.16 145.7 52.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.951 0.405 . . . . 0.0 110.503 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.516 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.9 mt -75.89 -21.75 56.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -63.25 -43.11 98.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.168 175.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -73.24 -27.1 61.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.603 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.432 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -57.98 -62.81 1.55 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.064 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -63.63 -42.62 96.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -176.643 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.43 92.8 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.697 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -75.88 -42.19 49.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.876 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.576 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.1 m-85 -76.25 0.64 18.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.23 0.538 . . . . 0.0 111.79 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 t -80.97 -30.28 35.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 170.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -96.06 -40.08 9.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.853 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.576 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 3.5 m-70 -110.18 113.08 25.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.291 177.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.28 82.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.764 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.9 t70 68.23 -70.74 0.12 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.532 -1.213 . . . . 0.0 112.116 168.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -131.02 -29.71 0.6 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.331 -0.462 . . . . 0.0 111.981 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.574 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -60.93 -39.84 90.95 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.84 0.829 . . . . 0.0 112.275 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.4 t 83.17 -29.65 0.09 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 112.429 -2.169 . . . . 0.0 110.162 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -97.01 124.68 41.05 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 172.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.78 141.67 44.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.289 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CG ' ' A' ' 29' ' ' PHE . 66.8 mt -66.09 94.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.002 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.1 m -91.8 -63.81 1.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -172.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.4 p30 -133.24 163.35 29.49 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.624 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.4 t -102.26 145.64 11.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.026 0.441 . . . . 0.0 110.892 -174.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.9 t -57.74 137.29 82.87 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.43 -176.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 4.8 Cg_exo -76.33 176.54 9.93 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.527 2.818 . . . . 0.0 112.004 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.534 0.354 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.216 -178.406 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -56.27 -48.46 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.38 0.61 . . . . 0.0 110.216 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.676 ' HA ' HG11 ' A' ' 101' ' ' VAL . 8.4 p-90 -89.55 -44.3 10.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.3 -177.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.463 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 3.2 t80 -82.32 86.36 6.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.404 -175.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.556 ' CE2' ' HB ' ' A' ' 104' ' ' THR . 11.2 m-85 -69.86 -31.5 69.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.26 0.552 . . . . 0.0 110.847 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.8 -148.35 18.9 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.355 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -83.76 68.8 10.04 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.73 0.3 . . . . 0.0 111.343 -174.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.7 pt -95.47 150.01 4.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 p -82.3 166.38 19.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -71.06 -20.71 62.33 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -65.18 -44.79 87.34 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.57 -51.97 24.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.708 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 t -51.89 -68.42 0.17 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.624 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -29.29 66.61 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -61.25 -58.05 9.88 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.195 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 mp -63.96 -36.51 84.2 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.699 HD21 HD22 ' A' ' 30' ' ' LEU . 89.3 mt -70.54 -40.93 73.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.648 -177.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.33 57.96 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.324 0.583 . . . . 0.0 111.023 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -121.08 119.25 29.83 Favored Pre-proline 0 C--N 1.321 -0.664 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 172.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 31.8 Cg_exo -60.28 -11.67 17.13 Favored 'Trans proline' 0 N--CA 1.473 0.321 0 C-N-CA 123.283 2.655 . . . . 0.0 113.187 -176.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -79.61 -19.15 49.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.95 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -87.92 130.31 47.06 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.046 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -84.85 166.99 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.683 2.255 . . . . 0.0 112.58 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.48 ' HD2' ' CE1' ' A' ' 96' ' ' HIS . 53.1 ttp180 -57.1 128.74 38.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.447 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.66 1.3 30.71 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.902 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 70.9 m -77.66 119.88 21.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 175.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.4 p90 -134.45 174.08 10.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.909 0.385 . . . . 0.0 111.74 -173.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.699 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -171.13 147.59 2.58 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.036 171.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -101.26 118.08 47.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.443 0.64 . . . . 0.0 110.771 179.261 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.429 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 18.1 ptt180 -117.31 155.71 29.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.121 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -99.63 135.83 40.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.002 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.451 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 43.1 t -84.71 121.6 27.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.009 0.433 . . . . 0.0 111.097 -178.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -81.0 -18.18 47.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.48 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.59 -28.19 26.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.747 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 61.7 m -135.06 93.24 2.97 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.194 0.521 . . . . 0.0 110.627 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 34' ' ' SER . 14.3 mmmm -71.72 113.23 8.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.851 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 122.62 3.13 9.43 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.49 -175.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.97 116.67 10.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.013 0.435 . . . . 0.0 109.908 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.794 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 17.4 m-85 -92.66 161.64 14.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.655 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.429 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 60.8 m -118.67 101.32 8.02 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.969 0.414 . . . . 0.0 110.71 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.3 tm? -77.56 97.95 5.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 5.0 m -92.34 105.63 17.79 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.122 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -113.56 136.67 49.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.043 0.449 . . . . 0.0 110.892 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.6 t -86.96 127.15 35.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.481 0.658 . . . . 0.0 110.632 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.454 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 7.4 t70 -112.34 140.08 47.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.791 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.434 ' CB ' ' HB2' ' A' ' 26' ' ' ARG . 78.9 t80 -111.11 114.88 28.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.091 0.472 . . . . 0.0 110.457 -176.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -112.35 153.75 26.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.072 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -75.51 -20.23 58.86 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.997 -172.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -112.25 -49.41 2.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -80.35 -17.48 51.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -176.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.71 -146.05 28.11 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.869 -0.682 . . . . 0.0 111.891 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.33 125.12 28.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.89 0.376 . . . . 0.0 110.373 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -131.37 138.11 49.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 77.9 t -98.64 124.23 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.165 0.507 . . . . 0.0 110.91 -176.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 57.0 mttm -102.88 116.68 33.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.974 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -91.69 94.94 9.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.583 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.493 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 62.3 m-85 -77.14 128.95 35.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.347 178.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -81.84 116.65 21.61 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 -176.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.794 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.5 mt -96.44 84.09 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 70' ' ' TYR . 43.9 ttm180 -90.12 139.04 31.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.474 . . . . 0.0 111.328 -172.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . 51.4 tttp -90.13 133.3 34.96 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.352 177.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.2 -81.36 0.13 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 177.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -170.13 -64.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.419 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 34.0 p -120.25 -23.28 6.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.714 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -64.7 -52.47 42.37 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.216 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.16 -147.64 19.32 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.344 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.612 ' CE2' ' HB2' ' A' ' 63' ' ' LYS . 84.2 m-85 -108.87 141.27 41.17 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.614 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 48.9 p90 -135.53 143.66 45.86 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.289 0.566 . . . . 0.0 111.398 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.528 HG12 HG12 ' A' ' 61' ' ' ILE . 61.3 mt -95.08 -24.78 4.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.914 171.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.3 t -133.6 149.64 51.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.2 m -78.39 59.73 2.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.932 -174.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 74' ' ' ARG . 13.8 ptt180 -169.28 -47.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.817 173.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.3 m -99.93 130.06 46.07 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.8 pt20 -149.66 153.9 37.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.749 0.309 . . . . 0.0 111.281 -174.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.47 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 93.2 m-85 -139.0 141.57 38.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.618 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.0 p -80.97 -10.8 59.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.617 0.246 . . . . 0.0 111.658 -174.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.5 m -132.29 138.48 47.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.643 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.11 -31.65 72.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.91 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -59.1 -48.64 80.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.611 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.415 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 14.4 mm-40 -65.56 -40.72 93.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.647 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.496 HD13 ' N ' ' A' ' 84' ' ' VAL . 1.3 tm? -51.04 -57.98 7.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.615 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.496 ' N ' HD13 ' A' ' 83' ' ' LEU . 9.2 p -75.64 -42.44 41.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.515 -170.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.84 83.96 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.335 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -76.66 -42.99 39.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.854 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.554 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -74.86 -16.66 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -175.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.743 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 79.8 p -69.41 -14.57 62.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.795 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -113.2 -59.23 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.354 0.597 . . . . 0.0 109.543 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 92' ' ' ASP . 6.5 t60 -98.84 95.33 7.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.796 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.85 -31.12 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 0.0 111.564 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.696 ' HB2' ' HD2' ' A' ' 90' ' ' HIS . 5.5 t70 53.3 -88.08 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.827 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.51 -43.62 12.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.408 -177.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.657 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -67.99 137.17 54.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.888 0.375 . . . . 0.0 110.81 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.72 -19.92 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.522 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.48 ' CE1' ' HD2' ' A' ' 26' ' ' ARG . 94.0 m-70 -120.03 139.51 52.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.455 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -74.76 134.21 41.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.669 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.743 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 84.9 mt -62.18 99.67 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.147 0.499 . . . . 0.0 109.783 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.7 m -84.73 -63.97 1.24 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.827 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.3 p30 -137.71 143.42 41.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.809 0.337 . . . . 0.0 110.22 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.676 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.9 t -88.3 132.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.4 t -65.4 128.35 93.72 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.58 147.09 35.39 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.491 2.127 . . . . 0.0 112.043 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.556 ' HB ' ' CE2' ' A' ' 7' ' ' PHE . 5.5 t . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 0.0 110.817 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 6' ' ' TYR . 20.9 mt-10 . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 119.96 -0.067 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 30.2 mt-10 74.14 -47.94 0.65 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.829 0.852 . . . . 0.0 110.313 -171.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.419 ' HE3' HG11 ' A' ' 31' ' ' VAL . 1.4 p-90 -89.76 -32.99 16.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.739 ' HB3' ' HA ' ' A' ' 3' ' ' GLU . 3.1 t80 -80.09 94.31 5.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.826 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.539 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 35.4 m-85 -85.75 -13.08 49.4 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.922 0.392 . . . . 0.0 111.133 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.29 -153.51 29.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.645 176.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.509 ' CG ' ' HB2' ' A' ' 33' ' ' GLU . 30.4 mtmm -82.04 53.88 2.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.856 0.36 . . . . 0.0 111.819 -175.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.463 HD13 ' HB3' ' A' ' 7' ' ' PHE . 34.2 pt -77.5 140.89 16.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 173.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -70.14 163.67 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' ' NH1' ' A' ' 32' ' ' ARG . 13.4 ptp180 -57.29 -32.78 66.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.212 0.529 . . . . 0.0 110.153 176.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -60.84 -49.07 78.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.346 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -67.94 -57.35 6.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.32 -177.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.454 ' HB3' ' CD1' ' A' ' 10' ' ' ILE . 5.4 p -62.17 -52.39 64.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.864 -172.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.43 -29.21 61.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -172.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.437 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 17.0 tpt180 -69.09 -29.58 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.95 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.31 -43.21 86.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 46' ' ' SER . 6.3 mp -74.8 -31.5 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.48 ' HA ' HD13 ' A' ' 20' ' ' LEU . 2.9 mm? -78.77 -7.68 58.03 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.098 0.406 . . . . 0.0 112.098 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.48 ' OD1' ' HD2' ' A' ' 22' ' ' PRO . 63.1 t30 -68.78 124.69 90.75 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.48 ' HD2' ' OD1' ' A' ' 21' ' ' ASN . 57.2 Cg_endo -70.46 46.68 0.61 Allowed 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 123.246 2.631 . . . . 0.0 114.553 -172.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -127.54 -4.66 5.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.102 0.477 . . . . 0.0 109.89 173.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -92.93 131.46 33.34 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.085 -176.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -86.31 162.64 9.82 Favored 'Trans proline' 0 C--O 1.239 0.559 0 C-N-CA 122.813 2.342 . . . . 0.0 111.776 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.626 ' HB2' ' HB2' ' A' ' 48' ' ' PHE . 3.2 ttm180 -60.96 117.87 6.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.18 -6.29 7.23 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.113 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.587 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 28.0 m -74.92 112.82 11.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 176.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.523 ' CG ' HD22 ' A' ' 98' ' ' LEU . 34.5 p90 -125.68 161.34 27.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.987 0.422 . . . . 0.0 111.839 -174.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.2 pt? -159.99 138.2 10.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.401 171.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.45 HG13 ' HA ' ' A' ' 6' ' ' TYR . 0.1 OUTLIER -98.97 114.76 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.463 0.649 . . . . 0.0 110.585 178.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 29.9 ptt180 -108.22 149.28 28.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.465 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.591 ' HG2' ' CE2' ' A' ' 41' ' ' TYR . 33.1 mt-10 -87.22 126.13 34.62 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 t -74.72 115.9 14.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.179 0.514 . . . . 0.0 110.103 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.29 -17.08 63.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.786 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.1 m -78.85 -34.76 44.79 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.281 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.7 m -136.67 113.56 10.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.957 0.408 . . . . 0.0 110.928 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -70.51 121.72 18.33 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.033 0.444 . . . . 0.0 110.638 -178.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.668 ' HA3' ' HD2' ' A' ' 63' ' ' LYS . . . 102.05 -4.86 52.66 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.016 -178.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.42 113.3 26.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.082 0.468 . . . . 0.0 110.169 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.782 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 69.1 m-85 -102.4 141.32 35.41 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.598 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 56.7 m -103.2 103.91 14.0 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.654 ' HB3' ' HB2' ' A' ' 59' ' ' TYR . 2.4 tm? -79.67 86.9 5.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 172.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.2 m -84.81 114.78 22.33 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.001 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.92 136.55 50.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.938 0.399 . . . . 0.0 110.244 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.519 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 t -78.16 115.45 17.9 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.591 0.71 . . . . 0.0 109.2 172.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -110.25 136.85 48.8 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.445 -1.252 . . . . 0.0 108.982 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 26' ' ' ARG . 56.6 t80 -82.02 126.38 31.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.985 0.421 . . . . 0.0 110.4 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.437 ' HB2' HD22 ' A' ' 55' ' ' ASN . 14.9 t70 -117.54 146.66 43.42 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.3 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.27 -13.9 56.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.839 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.26 -41.19 3.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.815 0.341 . . . . 0.0 110.792 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -85.91 -24.51 26.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.94 -73.14 1.99 Allowed Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -175.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.08 132.7 49.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.437 HD22 ' HB2' ' A' ' 49' ' ' ASP . 7.0 p30 -132.4 140.38 48.44 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 60.2 t -92.71 109.29 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.25 0.548 . . . . 0.0 110.347 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.435 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 34.9 ttmt -92.26 105.21 17.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.74 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -86.6 107.93 18.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.063 -177.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.654 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 99.1 m-85 -86.11 121.79 29.21 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -83.49 109.77 17.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.615 0.721 . . . . 0.0 111.412 -177.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.782 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 72.0 mt -86.95 99.93 9.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.545 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -95.33 146.99 23.97 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.511 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.668 ' HD2' ' HA3' ' A' ' 39' ' ' GLY . 0.1 OUTLIER -92.74 139.08 30.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.244 0.545 . . . . 0.0 109.914 177.623 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.442 HD11 ' NE2' ' A' ' 76' ' ' GLN . 13.9 mt -84.17 159.5 21.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.768 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -74.85 74.3 2.12 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.842 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.8 m 81.82 26.93 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.893 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.11 -38.87 1.46 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.877 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 145.39 -139.1 8.08 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 121.236 -0.506 . . . . 0.0 111.917 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -129.08 145.94 51.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -150.92 139.33 20.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.173 0.511 . . . . 0.0 111.507 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.538 HD12 ' CE2' ' A' ' 87' ' ' TYR . 33.0 mt -89.04 -30.37 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.913 0.864 . . . . 0.0 108.965 170.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -136.88 144.97 43.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.067 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.6 p -66.53 -11.04 50.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.238 -173.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.1 ptm180 -85.64 -20.7 29.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.041 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 m -135.69 112.27 10.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 0.0 111.327 -174.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.442 ' NE2' HD11 ' A' ' 64' ' ' LEU . 62.8 mt-30 -115.55 143.93 44.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.668 -176.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.418 ' HZ ' ' CD2' ' A' ' 86' ' ' TYR . 94.7 m-85 -126.97 162.73 25.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.116 177.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 t -86.72 -29.98 22.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.852 -0.158 . . . . 0.0 111.305 -177.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 88.3 p -143.81 167.77 21.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.619 0.247 . . . . 0.0 110.703 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 83' ' ' LEU . 2.6 mm? -65.47 -26.4 67.92 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.8 0.333 . . . . 0.0 111.161 177.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.32 -43.16 91.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.429 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -70.1 -31.0 68.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 2.2 tm? -55.78 -68.23 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.699 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.96 -41.67 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -173.587 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.98 -27.89 47.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.039 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.418 ' CD2' ' HZ ' ' A' ' 77' ' ' PHE . 85.5 t80 -84.24 -52.39 6.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.85 178.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.538 ' CE2' HD12 ' A' ' 71' ' ' ILE . 22.5 m-85 -65.37 -15.91 63.06 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.629 -175.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.643 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.9 t -66.23 -32.02 73.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.007 0.432 . . . . 0.0 110.441 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.488 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 73.3 mmtt -113.59 -41.01 3.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.849 -176.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.534 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 13.1 m-70 -120.99 110.17 15.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -72.41 -39.25 68.07 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.98 -176.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 65.36 -75.52 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.628 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.79 -34.8 4.52 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.593 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -58.42 142.09 49.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.307 0.575 . . . . 0.0 111.238 176.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 20.7 m -74.45 -24.99 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.875 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -137.38 147.95 45.87 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.664 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 89' ' ' LYS . 40.3 mtm180 -84.71 135.77 34.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.037 -177.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 81.7 mt -55.8 110.35 0.71 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.905 0.384 . . . . 0.0 110.537 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -94.92 -63.25 1.19 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.386 -174.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -134.74 146.93 49.87 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.404 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.5 t -83.37 153.39 3.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.014 -178.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.3 t -59.28 136.52 88.56 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.668 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.7 Cg_exo -65.68 146.11 83.2 Favored 'Trans proline' 0 C--N 1.347 0.447 0 C-N-CA 123.012 2.474 . . . . 0.0 111.553 175.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 p . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.667 -177.486 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 120.43 0.157 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -57.27 -52.67 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.04 0.448 . . . . 0.0 110.434 174.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -71.61 -35.97 70.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.946 -177.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.437 ' HA ' HG13 ' A' ' 31' ' ' VAL . 39.3 t80 -89.41 101.06 13.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.889 0.376 . . . . 0.0 110.793 -176.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.476 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 15.5 m-85 -84.37 -33.62 23.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.369 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 124.83 -166.8 17.36 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.321 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.829 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 14.1 pttp -89.5 59.28 4.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.877 0.846 . . . . 0.0 111.229 -178.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.1 pt -76.42 149.21 6.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.671 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 47.2 p -82.35 167.75 18.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -61.84 -38.55 88.62 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.621 -177.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -41.29 68.6 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.232 0.539 . . . . 0.0 110.694 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -78.49 -47.59 17.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.491 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -61.35 -48.43 81.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.477 -176.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.62 -32.37 69.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.021 -176.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -60.05 -30.57 69.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.95 -40.39 28.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.095 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 30' ' ' LEU . 74.5 mt -81.96 -23.11 36.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.8 mm? -85.22 42.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.338 0.589 . . . . 0.0 111.261 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -104.62 128.78 26.19 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 169.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.665 ' HA ' HD11 ' A' ' 54' ' ' LEU . 11.9 Cg_endo -55.23 -22.15 31.43 Favored 'Trans proline' 0 N--CA 1.473 0.306 0 C-N-CA 123.495 2.797 . . . . 0.0 114.549 -170.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -98.74 23.75 8.39 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.852 -177.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 14.6 m-80 -78.17 115.46 51.03 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 120.853 0.359 . . . . 0.0 110.045 173.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 21.5 Cg_exo -65.35 154.32 74.16 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.907 2.405 . . . . 0.0 111.956 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -66.16 109.1 2.49 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.484 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.91 22.55 5.62 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.544 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 61.5 m -83.73 124.38 30.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 175.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.473 ' CG ' HD22 ' A' ' 98' ' ' LEU . 29.5 p90 -133.29 161.62 34.0 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.92 138.23 9.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.788 170.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.471 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.1 p -103.47 118.91 51.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.666 0.746 . . . . 0.0 110.855 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 19.0 ptt85 -112.67 148.81 33.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.443 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.829 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 35.0 tt0 -83.93 134.99 34.64 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 37' ' ' THR . 38.0 m -73.75 130.06 39.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.434 0.635 . . . . 0.0 111.565 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -79.36 -18.7 51.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.488 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.2 p -119.89 9.22 11.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 34' ' ' SER . 78.9 m -153.79 124.63 7.25 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.758 0.313 . . . . 0.0 110.653 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -103.64 138.87 39.7 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.789 0.328 . . . . 0.0 110.131 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.31 9.38 56.88 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -175.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -150.44 120.75 7.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.938 0.399 . . . . 0.0 110.392 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 57.0 m-85 -101.3 165.01 11.5 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.454 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 32.4 t -117.47 111.64 19.56 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.744 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.471 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.3 tm? -90.71 87.03 6.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.4 m -78.28 122.09 25.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.869 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 p -118.67 138.43 49.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.96 0.41 . . . . 0.0 110.331 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -94.19 128.96 40.93 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.604 0.716 . . . . 0.0 110.063 179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -112.16 133.23 54.42 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.519 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -105.97 112.52 25.61 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.457 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -118.59 147.74 43.4 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.469 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -79.58 -13.36 59.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.719 -174.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.21 -44.0 2.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 111.246 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -81.4 -20.59 40.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.064 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 85.94 -133.11 11.55 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.98 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.665 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.0 mt -96.84 109.65 22.31 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.146 0.498 . . . . 0.0 110.284 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -105.87 116.52 32.08 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.009 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 82.7 t -91.62 107.8 19.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.151 0.5 . . . . 0.0 109.937 178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -95.31 114.52 26.31 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.216 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -89.56 87.11 6.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.537 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.449 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 76.8 m-85 -76.46 157.38 32.25 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -123.04 120.6 33.81 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.22 0.533 . . . . 0.0 111.51 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.615 HG12 HG12 ' A' ' 71' ' ' ILE . 52.8 mt -89.8 88.24 2.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.782 176.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -93.71 154.46 17.78 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.504 -174.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 21.4 pttp -109.8 142.6 40.83 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.105 0.479 . . . . 0.0 110.214 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.483 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 45.2 mt -78.97 175.01 10.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.801 177.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -62.06 -46.27 89.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.705 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.9 t -153.28 58.71 0.77 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -140.59 -33.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.839 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 121.73 -158.97 16.41 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.248 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.67 147.84 25.54 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.448 0.299 . . . . 0.0 110.389 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.483 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 44.9 p90 -156.04 143.23 19.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.602 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.705 HG21 HD11 ' A' ' 94' ' ' LEU . 62.0 mt -83.86 -29.78 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.578 0.704 . . . . 0.0 109.134 173.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.459 HG21 ' HA3' ' A' ' 93' ' ' GLY . 11.5 t -146.12 161.06 41.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.472 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.8 p -78.07 59.34 2.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.986 0.422 . . . . 0.0 111.304 -177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -132.04 -78.98 0.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.37 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.8 m -100.67 122.42 43.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.335 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -104.17 147.11 27.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.262 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.587 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 95.9 m-85 -132.02 142.25 49.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 121.343 0.592 . . . . 0.0 111.391 -178.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -72.67 -21.3 61.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.517 -177.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.1 p -141.34 172.66 12.37 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.82 0.343 . . . . 0.0 111.231 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 85.7 mt -79.52 -28.19 41.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.712 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -64.9 -43.7 92.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.43 HE21 ' HD1' ' A' ' 77' ' ' PHE . 26.4 mt-30 -60.76 -36.76 79.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.393 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 71' ' ' ILE . 3.2 tm? -55.75 -67.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.564 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.415 ' H ' HG22 ' A' ' 84' ' ' VAL . 0.2 OUTLIER -62.9 -41.47 92.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -175.434 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.94 -34.92 66.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.79 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.976 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.764 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 34.9 m-85 -70.93 -7.75 48.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.373 -176.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.585 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.9 t -71.31 -23.04 61.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.188 0.518 . . . . 0.0 110.08 173.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -116.05 -45.75 2.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.177 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.764 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 24.9 m-70 -111.06 116.67 31.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.049 177.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.58 -24.51 64.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.529 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 35.3 t70 62.63 -81.8 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.612 0.765 . . . . 0.0 112.072 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.459 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -101.53 -33.26 4.85 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.743 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.705 HD11 HG21 ' A' ' 71' ' ' ILE . 4.0 mp -71.0 171.05 11.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.052 0.453 . . . . 0.0 110.329 175.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . 0.437 ' HG ' ' CE1' ' A' ' 96' ' ' HIS . 5.5 p -114.3 12.74 17.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.455 0.645 . . . . 0.0 109.514 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 95' ' ' CYS . 79.2 m80 -128.26 118.15 22.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.001 -0.999 . . . . 0.0 109.756 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 97' ' ' ARG . 33.5 mtt180 -75.66 133.6 40.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 64.8 mt -66.49 88.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.4 m -88.49 -57.5 2.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.439 -171.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.5 p-10 -130.64 145.2 51.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.824 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.88 158.4 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.842 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.3 t -56.4 133.64 76.48 Favored Pre-proline 0 C--N 1.327 -0.396 0 O-C-N 123.498 0.499 . . . . 0.0 111.292 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.34 154.56 56.17 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.697 2.265 . . . . 0.0 112.019 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.513 179.98 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.04 -50.11 28.96 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 123.62 0.575 . . . . 0.0 112.101 -172.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.491 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 4.6 p-90 -77.94 -31.23 50.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.358 -174.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.491 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 63.4 t80 -91.11 106.33 18.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.789 0.328 . . . . 0.0 111.082 -174.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 43.8 m-85 -94.55 15.32 18.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.511 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 81.79 -131.09 10.14 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.552 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -122.54 115.73 22.68 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.671 0.748 . . . . 0.0 110.033 176.59 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 14' ' ' GLU . 35.1 pt -131.85 154.08 39.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.045 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.7 p -96.9 179.85 4.81 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.549 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 12' ' ' ARG . 8.2 ptm180 -54.51 -32.04 57.3 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.191 0.307 . . . . 0.0 111.232 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 59.9 ttp180 -59.72 -51.79 68.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.902 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.566 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 11.8 mp0 -72.68 -45.81 57.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.934 0.397 . . . . 0.0 110.458 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.9 t -59.73 -66.87 0.45 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.959 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.06 -23.1 65.2 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -177.495 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -62.66 -42.44 99.62 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.2 0.524 . . . . 0.0 109.963 178.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.8 mt -80.89 -39.57 26.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.878 -177.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 30' ' ' LEU . 62.4 mt -79.45 -35.22 40.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.267 -172.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 3.9 mm? -83.21 14.18 3.68 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.177 0.513 . . . . 0.0 110.524 177.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -92.82 107.19 22.61 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 172.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -72.63 49.17 1.44 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.327 2.685 . . . . 0.0 114.416 -169.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -119.63 4.72 11.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.345 0.593 . . . . 0.0 109.839 172.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -104.59 144.25 28.33 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.339 -178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -84.61 168.7 11.11 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 123.156 2.571 . . . . 0.0 112.054 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -63.96 129.23 39.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.949 0.404 . . . . 0.0 110.834 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.19 3.67 31.24 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.213 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.508 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 85.4 m -72.33 109.15 5.86 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.902 -0.406 . . . . 0.0 109.902 175.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.472 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.5 p90 -126.83 161.31 28.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 111.621 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.59 143.64 13.26 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.41 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -107.78 122.13 61.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.69 0.757 . . . . 0.0 110.905 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.44 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 16.1 ptt180 -117.19 142.07 47.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.228 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -81.92 121.5 26.57 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.807 ' HB2' HG22 ' A' ' 37' ' ' THR . 4.2 m -77.54 113.15 15.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.686 0.279 . . . . 0.0 110.304 -177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -70.54 -3.83 19.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.862 0.363 . . . . 0.0 111.477 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.7 t -95.63 9.19 41.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.139 0.495 . . . . 0.0 110.7 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.96 HG21 ' HB3' ' A' ' 40' ' ' ALA . 11.1 t -150.14 169.78 20.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.734 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -123.67 30.08 6.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.558 0.694 . . . . 0.0 110.736 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.459 ' HA2' ' HE2' ' A' ' 63' ' ' LYS . . . 171.2 44.18 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.801 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.96 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -152.34 101.44 2.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.146 0.498 . . . . 0.0 110.614 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 41.9 m-85 -90.71 149.37 22.08 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.82 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.0 m -108.92 106.48 16.48 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.694 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.475 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -84.41 88.2 7.27 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m -85.5 108.75 18.07 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.357 -176.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.2 p -107.89 124.56 64.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.336 0.589 . . . . 0.0 110.653 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.6 t -79.39 129.81 34.82 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.138 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.34 115.65 13.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.136 -176.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -83.45 83.97 7.69 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 170.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -71.21 110.31 5.78 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.03 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -74.19 73.65 1.77 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.203 0.525 . . . . 0.0 110.552 -172.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.82 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.938 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -121.93 -34.57 3.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.709 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.77 -148.45 16.86 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.648 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -75.51 114.93 14.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.0 111.67 -177.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -126.13 117.39 23.04 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 91.9 t -88.93 106.2 16.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -84.23 102.26 12.5 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.12 -175.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 32' ' ' ARG . 15.2 m-70 -80.98 93.89 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.914 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.691 ' HB3' HG23 ' A' ' 71' ' ' ILE . 57.4 m-85 -77.13 124.62 28.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.119 0.485 . . . . 0.0 110.025 177.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -88.23 110.9 21.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.07 -170.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.718 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 54.4 mt -91.45 94.25 4.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.793 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.2 ttp180 -92.01 157.07 16.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.745 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' ' HA2' ' A' ' 39' ' ' GLY . 43.5 mtmt -97.88 147.23 24.65 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.624 0.726 . . . . 0.0 112.168 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.477 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 87.1 mt -115.84 130.55 56.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.332 -1.303 . . . . 0.0 109.212 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -72.54 -22.6 60.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.938 0.399 . . . . 0.0 110.482 -178.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 p -113.89 30.97 6.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.789 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.41 -94.08 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.325 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.477 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 173.52 -134.01 2.77 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.828 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -99.26 137.02 38.36 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' A' ' 61' ' ' ILE . 25.8 p90 -144.11 140.46 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.167 0.508 . . . . 0.0 110.839 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 59.2 mt -87.0 -35.37 8.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.781 174.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.2 t -143.63 159.75 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.452 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -75.88 57.28 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.507 0.67 . . . . 0.0 110.739 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -130.74 -64.45 0.83 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.773 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.2 m -134.47 123.01 23.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.698 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.29 144.06 44.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.679 0.276 . . . . 0.0 110.831 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -127.62 147.3 50.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 p -83.35 10.5 8.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.126 0.489 . . . . 0.0 111.125 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLN . 30.0 m -148.65 135.23 19.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.773 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.634 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.9 mt -63.25 -35.2 79.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.647 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -61.73 -46.06 91.26 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.713 0.292 . . . . 0.0 110.819 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.405 ' HG2' ' HB2' ' A' ' 79' ' ' SER . 13.9 mm100 -61.34 -38.63 87.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.821 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -58.42 -64.14 1.03 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.994 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.9 m -63.51 -45.31 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.61 -33.64 68.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -78.12 -46.3 21.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.832 0.349 . . . . 0.0 110.462 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-85 -73.11 -7.33 50.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.442 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.601 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 28.0 t -74.67 -15.92 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.281 0.562 . . . . 0.0 109.851 174.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -120.58 -51.42 2.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.626 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.0 t-80 -103.4 107.06 17.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.76 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 66.92 -65.48 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.071 0.548 . . . . 0.0 112.458 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -125.6 -30.93 0.86 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.952 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.581 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.3 mp -64.92 148.28 51.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.281 0.562 . . . . 0.0 111.183 178.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 62.2 m -78.4 -6.97 56.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.933 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -152.71 144.33 23.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -67.62 145.62 54.67 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.91 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 87.5 mt -64.79 95.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.7 m -90.34 -60.5 1.91 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.754 -171.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.8 p-10 -131.66 141.19 49.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -176.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -80.87 149.95 4.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.7 t -56.7 117.95 20.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 2.7 Cg_exo -75.18 147.37 33.17 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.912 2.408 . . . . 0.0 110.712 173.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 t . . . . . 0 C--N 1.321 -0.642 0 CA-C-O 121.167 0.508 . . . . 0.0 110.793 -178.603 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.821 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -98.89 -54.99 2.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.273 0.558 . . . . 0.0 110.063 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.436 ' HE3' ' CG1' ' A' ' 31' ' ' VAL . 5.3 p-90 -68.6 -28.73 67.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.854 -176.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.421 ' HA ' HG13 ' A' ' 31' ' ' VAL . 23.9 t80 -80.89 125.93 30.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.199 -178.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 16.9 m-85 -118.62 34.6 5.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.043 0.449 . . . . 0.0 111.9 -178.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.5 -141.52 35.43 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.934 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 33.0 mtmm -117.98 48.34 1.41 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.74 0.305 . . . . 0.0 111.22 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 pt -67.81 151.32 10.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.56 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.3 p -80.62 172.46 13.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.203 -178.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -59.77 -48.22 82.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 110.283 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.8 -47.5 77.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.137 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.2 -41.13 97.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.931 0.396 . . . . 0.0 110.826 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 22.7 t -62.95 -48.15 80.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.283 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HB3' HD23 ' A' ' 20' ' ' LEU . 61.3 mt-10 -69.74 -27.91 65.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.357 -178.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -60.74 -30.19 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.224 0.535 . . . . 0.0 110.374 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.14 -28.49 18.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.469 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.563 HD21 HD22 ' A' ' 30' ' ' LEU . 83.3 mt -93.83 -34.23 13.24 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.1 mm? -79.17 49.43 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.481 0.658 . . . . 0.0 111.179 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -125.23 112.81 26.18 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.82 41.76 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.998 2.465 . . . . 0.0 113.326 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -128.45 9.44 6.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.931 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -110.5 149.88 40.87 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.681 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -82.92 157.68 15.62 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.81 2.34 . . . . 0.0 112.158 176.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -62.94 140.07 58.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 120.898 0.38 . . . . 0.0 110.396 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.97 2.43 59.43 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.39 -0.909 . . . . 0.0 111.667 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.712 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 65.3 m -73.2 110.79 7.76 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.583 ' CG ' HD22 ' A' ' 98' ' ' LEU . 27.0 p90 -127.35 158.07 38.24 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.124 0.487 . . . . 0.0 111.586 -172.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.588 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.6 pt? -152.24 132.86 13.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.504 170.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 5' ' ' TRP . 2.6 p -103.1 114.27 42.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.964 -177.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 24.4 ptt85 -109.1 144.16 37.5 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.07 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.685 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 36.6 tt0 -83.36 138.21 33.62 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.131 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 45.4 t -88.01 138.15 31.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.336 0.589 . . . . 0.0 111.686 -175.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -93.34 -15.85 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.307 175.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.3 p -98.96 -5.56 30.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -173.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.447 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 17.6 m -148.69 131.63 16.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.714 0.292 . . . . 0.0 110.734 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.98 121.33 26.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.47 -178.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.72 31.23 36.87 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.143 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -130.45 128.84 42.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.92 0.39 . . . . 0.0 110.241 178.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -119.86 147.67 44.41 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.81 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 35.4 m -105.15 94.75 5.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.529 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.7 tm? -77.93 88.86 4.1 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 174.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.6 m -87.27 114.84 24.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.488 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -120.25 141.2 41.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.086 0.469 . . . . 0.0 111.124 -176.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.0 t -84.15 129.36 34.9 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.801 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 25.5 t0 -123.61 61.12 1.07 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.435 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.71 111.44 3.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.381 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 52' ' ' LYS . 9.9 t70 -114.97 144.12 44.09 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.448 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -75.06 -12.44 60.32 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.927 -170.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -104.27 -44.22 5.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.856 0.36 . . . . 0.0 111.304 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.856 ' HG3' HD21 ' A' ' 55' ' ' ASN . 6.6 ptpp? -101.19 -9.0 21.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.19 0.519 . . . . 0.0 111.575 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.49 -148.71 19.73 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.544 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 86.0 mt -80.73 114.6 19.73 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.41 0.284 . . . . 0.0 111.129 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.856 HD21 ' HG3' ' A' ' 52' ' ' LYS . 13.4 m-80 -115.13 124.05 50.52 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.622 HG21 HD22 ' A' ' 20' ' ' LEU . 79.8 t -111.59 114.66 47.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.211 0.529 . . . . 0.0 110.373 177.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -97.81 105.59 17.76 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.106 -176.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -81.61 83.9 6.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -67.34 127.07 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.29 0.567 . . . . 0.0 111.864 -176.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -82.04 96.1 7.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.485 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.704 HD11 ' HB2' ' A' ' 43' ' ' LEU . 58.6 mt -74.92 97.72 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 175.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -91.4 137.8 32.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.383 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' PHE . 51.2 pttt -91.83 151.57 20.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.253 0.549 . . . . 0.0 109.983 174.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.43 157.51 20.46 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 168.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -51.32 -44.08 61.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.3 m -67.51 -26.84 66.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 123.02 42.74 0.39 Allowed Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.37 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.61 108.66 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.917 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 63' ' ' LYS . 84.7 m-85 -84.97 130.13 34.68 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -143.12 143.25 31.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.394 0.616 . . . . 0.0 111.306 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 70.8 mt -92.4 -39.44 11.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.469 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.8 t -114.78 147.89 39.15 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.813 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.0 p -67.81 -7.24 26.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 74' ' ' ARG . 63.7 mtt180 -83.74 -57.61 3.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.904 0.383 . . . . 0.0 110.812 178.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 86' ' ' TYR . 1.3 m -101.68 104.82 15.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.812 -171.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -113.96 133.87 55.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.668 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 83' ' ' LEU . 83.8 m-85 -124.49 146.6 48.87 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.2 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.4 t -88.23 -2.39 58.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 45.5 m -144.03 137.35 27.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.054 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.538 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.9 mt -65.38 -23.46 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -56.52 -47.72 78.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.297 0.57 . . . . 0.0 110.204 174.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -73.36 -27.2 61.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.638 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 3.4 tm? -59.12 -64.74 0.83 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.262 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.25 -44.31 97.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.755 -176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.76 -42.27 62.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.032 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.415 ' CD2' HG21 ' A' ' 75' ' ' THR . 91.2 t80 -78.14 -43.05 29.91 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.641 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -69.84 -12.34 61.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.665 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.475 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 50.0 m -72.63 -22.36 60.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.274 0.559 . . . . 0.0 110.096 173.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -104.59 -44.47 4.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.643 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.641 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 31.6 m-70 -125.5 114.81 19.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -76.39 -40.71 50.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.69 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.469 ' HB3' HG21 ' A' ' 72' ' ' THR . 12.2 t70 65.42 -76.32 0.04 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.732 177.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.03 -40.42 8.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.209 -0.52 . . . . 0.0 112.156 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.649 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.5 mp -67.4 150.15 49.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.061 0.457 . . . . 0.0 110.47 178.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 32.6 t -72.68 -18.03 61.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.558 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -149.79 139.68 21.89 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.625 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 32.7 ptt85 -73.58 158.18 35.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.093 0.473 . . . . 0.0 111.515 -176.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.583 HD22 ' CG ' ' A' ' 29' ' ' PHE . 59.6 mt -66.52 101.3 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.062 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.8 m -97.65 -41.5 8.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.636 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.712 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.0 t30 -141.65 132.74 26.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.026 0.441 . . . . 0.0 110.511 -175.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.4 t -81.06 139.39 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.458 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.0 t -53.65 118.76 15.82 Favored Pre-proline 0 C--N 1.33 -0.251 0 O-C-N 123.507 0.504 . . . . 0.0 111.135 -176.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.73 151.96 46.98 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.469 2.113 . . . . 0.0 111.558 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 C--N 1.322 -0.625 0 CA-C-O 120.943 0.401 . . . . 0.0 110.07 176.739 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.43 -28.51 13.18 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.538 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.79 ' HA ' HG11 ' A' ' 101' ' ' VAL . 15.3 p-90 -82.03 -28.72 32.35 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -99.59 110.15 22.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.118 0.485 . . . . 0.0 110.612 -174.668 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -98.94 -0.9 41.27 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.0 -156.6 23.75 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.193 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -86.47 61.35 6.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.396 0.617 . . . . 0.0 111.547 -177.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.557 HD11 HD13 ' A' ' 30' ' ' LEU . 46.3 pt -74.47 138.0 21.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 174.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.6 p -72.94 159.73 33.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 15' ' ' SER . 10.2 ptm180 -67.2 -23.54 65.75 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.883 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 23.2 tpt180 -61.89 -39.0 90.43 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.96 -35.42 64.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.791 176.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.523 ' HB3' ' HA ' ' A' ' 12' ' ' ARG . 29.0 t -60.52 -67.21 0.42 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.981 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.437 ' OE2' ' HB2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -54.48 -38.85 66.9 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.739 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -57.15 -39.46 75.27 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -177.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.0 mt -86.6 -34.89 19.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.6 mt -81.07 -17.96 48.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.215 -174.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.54 14.08 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.591 0.234 . . . . 0.0 111.567 177.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.571 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 21.5 t30 -67.77 120.14 71.45 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -57.35 -20.78 41.35 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.043 2.495 . . . . 0.0 113.302 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -98.47 21.1 11.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.858 0.361 . . . . 0.0 111.472 -178.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.571 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 94.5 m-20 -89.82 118.21 68.76 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 170.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.91 144.3 64.02 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.152 1.901 . . . . 0.0 111.489 175.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.45 ' HB2' ' HB3' ' A' ' 48' ' ' PHE . 41.0 ttp180 -56.41 110.68 0.81 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.109 177.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.16 -0.6 7.08 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.644 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 37.1 m -77.36 129.05 35.31 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 28.6 p90 -139.39 171.25 14.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.151 0.5 . . . . 0.0 111.959 -173.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.557 HD13 HD11 ' A' ' 10' ' ' ILE . 3.4 pp -158.17 149.2 20.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.513 166.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.6 p -108.07 120.65 59.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.746 0.784 . . . . 0.0 110.814 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.687 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.8 145.95 37.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.279 -179.324 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -89.63 131.89 35.4 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.319 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.8 t -104.64 107.71 18.79 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -75.66 -3.04 32.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.965 0.412 . . . . 0.0 111.315 -173.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -42.64 87.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.33 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 29.6 m -121.19 127.55 51.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.356 -177.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -79.12 74.26 5.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.419 0.628 . . . . 0.0 110.366 -177.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.554 ' HA2' ' HE3' ' A' ' 63' ' ' LYS . . . 139.52 27.08 0.25 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.202 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -138.86 97.65 3.37 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.174 0.511 . . . . 0.0 110.457 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.774 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.7 m-85 -90.7 169.81 10.67 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.687 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -128.55 110.56 12.38 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.6 tm? -89.68 93.52 9.5 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 175.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 38.0 m -84.49 105.42 15.29 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -104.4 135.03 44.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 t -75.89 125.59 29.39 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.534 0.683 . . . . 0.0 110.467 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -105.94 133.04 51.29 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.173 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.523 ' HA ' ' O ' ' A' ' 53' ' ' GLY . 55.7 t80 -141.73 114.6 8.57 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.761 0.791 . . . . 0.0 112.679 -171.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.888 ' HB3' ' HA3' ' A' ' 53' ' ' GLY . 0.6 OUTLIER -84.75 142.31 29.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.862 165.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -58.91 -12.73 4.84 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -166.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -129.02 -54.32 1.2 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -117.85 -11.18 10.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -166.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.888 ' HA3' ' HB3' ' A' ' 49' ' ' ASP . . . -102.42 58.26 0.59 Allowed Glycine 0 C--O 1.225 -0.411 0 C-N-CA 119.807 -1.187 . . . . 0.0 115.394 -163.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 12.5 mt -90.47 131.4 36.24 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.932 0.866 . . . . 0.0 110.538 171.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.559 ' N ' HD22 ' A' ' 55' ' ' ASN . 0.1 OUTLIER -175.85 166.89 3.1 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.626 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.8 t -102.92 125.24 57.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 120.773 0.321 . . . . 0.0 110.176 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -99.22 101.44 12.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -82.19 104.06 12.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.334 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.401 ' HB3' HG23 ' A' ' 71' ' ' ILE . 54.2 m-85 -91.37 136.68 32.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.872 173.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -93.51 127.49 39.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.182 0.515 . . . . 0.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.774 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.6 mt -93.5 101.41 12.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.259 177.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.2 142.79 27.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.831 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HE3' ' HA2' ' A' ' 39' ' ' GLY . 26.0 ttpp -108.75 128.57 54.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.614 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.8 mt -75.81 150.69 37.65 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.876 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -53.06 -54.7 31.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.053 0.454 . . . . 0.0 111.406 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -129.87 45.69 2.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.208 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 -107.21 0.74 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.202 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -152.83 -151.11 5.59 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.778 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -110.15 141.82 42.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.769 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 46.4 p90 -147.38 137.59 23.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.161 0.505 . . . . 0.0 110.923 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.503 HG12 HG12 ' A' ' 61' ' ' ILE . 75.2 mt -84.65 -52.56 12.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -103.81 146.8 28.1 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.545 171.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.5 t -81.74 47.91 1.14 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.238 0.542 . . . . 0.0 111.02 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 73.3 mtp180 -135.37 -57.73 0.79 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.918 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 31.0 m -105.23 116.79 32.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.769 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.4 pt20 -133.73 148.51 51.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.259 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.52 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 96.1 m-85 -131.79 143.38 50.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.161 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.5 m -75.56 -5.1 43.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.5 m -140.88 144.12 35.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.248 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 84' ' ' VAL . 69.6 mt -68.26 -27.27 66.19 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.112 -176.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -54.28 48.9 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -59.38 -33.33 71.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.309 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' C ' ' A' ' 83' ' ' LEU . 3.4 tm? -58.51 -65.24 0.69 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.47 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.83 -44.92 96.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -175.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.32 -43.65 83.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.033 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -76.26 -36.18 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.416 -177.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 8.4 m-85 -79.88 0.18 32.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.92 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 50.2 m -67.64 -29.74 69.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.48 0.657 . . . . 0.0 109.47 173.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -115.72 -43.22 3.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.984 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.566 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 73.1 m80 -94.97 90.88 6.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.308 -178.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.704 ' HB2' ' HG3' ' A' ' 97' ' ' ARG . . . -66.12 -35.57 80.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.884 0.373 . . . . 0.0 110.195 177.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.86 -83.99 0.02 OUTLIER 'General case' 0 C--O 1.235 0.292 0 CA-C-N 114.788 -1.097 . . . . 0.0 111.908 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.24 -42.75 4.84 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.993 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.67 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -60.81 153.02 25.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.056 0.455 . . . . 0.0 110.964 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 25.3 p -88.13 -10.07 51.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.161 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -121.65 149.99 42.39 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.661 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.704 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -105.84 137.6 43.45 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.093 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.8 mt -68.62 87.17 0.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.175 0.512 . . . . 0.0 110.706 -177.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.7 m -80.41 -48.58 12.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.548 -173.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.502 ' O ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -155.24 152.71 29.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.791 0.329 . . . . 0.0 110.26 -178.804 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.79 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -91.52 140.35 16.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.996 -176.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.94 125.49 92.01 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.275 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.99 159.27 44.95 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.796 2.331 . . . . 0.0 111.683 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.913 -175.397 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 CA--C 1.523 -0.066 0 CA-C-O 121.4 0.619 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -54.9 -43.98 73.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.613 -168.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -76.56 -38.49 54.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.409 ' HA ' HG13 ' A' ' 31' ' ' VAL . 37.0 t80 -86.34 107.21 17.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 0.0 111.053 -173.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.487 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 27.1 m-85 -97.88 14.41 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.361 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.02 -143.42 28.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.763 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -111.17 51.6 0.77 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.138 0.494 . . . . 0.0 111.26 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 pt -61.73 147.17 11.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.057 175.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.7 p -87.82 -175.96 5.33 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.587 -177.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -39.51 94.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.97 0.414 . . . . 0.0 110.7 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -55.07 -48.22 73.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.321 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.66 -55.31 15.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.552 -176.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.9 p -61.36 -56.76 16.74 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -172.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HB3' HD23 ' A' ' 20' ' ' LEU . 1.6 mp0 -66.62 -29.25 69.24 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -176.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -66.46 -25.26 66.64 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.935 -0.478 . . . . 0.0 110.481 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.7 mt -85.52 -38.75 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.97 0.414 . . . . 0.0 110.794 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.42 HD11 HD21 ' A' ' 30' ' ' LEU . 81.7 mt -82.06 -28.67 32.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.162 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 20' ' ' LEU . 4.0 mm? -78.89 52.35 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.997 0.427 . . . . 0.0 111.442 178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 51.3 m-80 -136.33 132.02 18.78 Favored Pre-proline 0 C--N 1.32 -0.713 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 15.3 Cg_exo -69.41 7.67 0.85 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.303 2.669 . . . . 0.0 112.4 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -94.36 -1.0 54.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.053 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -97.21 129.18 32.73 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.09 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.516 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 15.2 Cg_exo -66.24 138.68 52.21 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.279 1.986 . . . . 0.0 111.087 173.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HD3' ' H ' ' A' ' 48' ' ' PHE . 45.7 ttp180 -61.79 101.31 0.19 Allowed 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.85 -3.12 3.42 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.505 -171.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 89.1 m -69.77 117.47 11.41 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 122.452 0.301 . . . . 0.0 110.457 175.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 36.5 p90 -123.98 164.68 18.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.067 0.46 . . . . 0.0 111.821 -175.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.9 pt? -164.22 146.02 8.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.709 173.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.544 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -112.94 120.18 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.52 0.676 . . . . 0.0 111.347 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.536 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 27.4 ptt180 -107.17 150.98 26.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.169 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -92.45 142.59 27.26 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 175.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.2 t -72.36 123.54 23.26 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -76.88 -15.25 59.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.909 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -101.09 -21.78 14.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.906 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 23.8 m -130.23 121.0 25.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.059 0.457 . . . . 0.0 111.479 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -85.25 115.4 23.0 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 1.034 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 115.1 11.74 10.61 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.603 -175.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.03 129.16 23.68 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.006 0.431 . . . . 0.0 110.493 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.777 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 88.4 m-85 -120.25 179.67 4.22 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.536 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 61.5 m -139.09 100.11 3.94 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.688 0.28 . . . . 0.0 110.332 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.8 tm? -82.94 95.96 8.15 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 174.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.5 t -93.19 143.09 26.59 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.91 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.8 p -136.05 133.01 50.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.155 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -80.14 126.61 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.592 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.4 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 5.5 t70 -128.52 147.59 50.7 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.792 -178.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.453 ' H ' ' HD3' ' A' ' 26' ' ' ARG . 87.8 t80 -133.34 113.66 12.84 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.335 0.588 . . . . 0.0 110.698 178.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.537 ' HB3' ' HD3' ' A' ' 52' ' ' LYS . 11.6 m-20 -105.8 137.99 42.75 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.84 173.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -71.4 -9.13 57.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.353 -173.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.17 -21.59 9.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.537 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -103.2 -23.8 13.6 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.858 0.361 . . . . 0.0 111.315 -177.106 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.05 23.09 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.69 114.79 17.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.928 0.394 . . . . 0.0 110.489 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -108.72 120.18 41.73 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.058 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 74.2 t -92.04 107.09 18.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.035 0.445 . . . . 0.0 109.971 175.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -91.51 100.38 13.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.944 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -85.56 88.99 7.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.491 . . . . 0.0 110.471 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.589 ' HB3' HG23 ' A' ' 71' ' ' ILE . 87.7 m-85 -77.79 88.04 4.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.542 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 42' ' ' CYS . 22.2 pttp -62.75 132.26 51.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.231 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.777 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 70.5 mt -98.8 125.9 52.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.499 -176.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -109.27 137.52 47.03 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.333 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 1.034 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 23.1 mtpp -84.71 145.21 28.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.502 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.99 -6.69 48.92 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 168.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.498 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 10.2 t70 73.93 -55.57 0.66 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.649 178.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.0 m -105.94 24.98 11.49 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.949 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.62 -107.82 0.46 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.291 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -129.42 -157.04 9.04 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.205 -174.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -119.38 141.75 48.79 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -146.07 136.05 23.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.507 0.67 . . . . 0.0 111.6 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.756 HG12 HG12 ' A' ' 61' ' ' ILE . 69.9 mt -82.77 -48.3 17.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.13 173.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -118.53 150.78 39.05 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.904 176.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -81.1 51.53 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -135.96 -77.53 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.326 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.0 m -94.47 104.47 16.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.209 0.528 . . . . 0.0 110.01 178.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -110.7 150.21 29.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 -173.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -129.51 141.55 50.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.977 0.417 . . . . 0.0 110.916 -178.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.521 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 15.8 m -83.1 20.46 1.23 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.686 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.9 t -167.57 161.45 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.548 ' O ' HG22 ' A' ' 84' ' ' VAL . 58.5 mt -83.48 -34.38 25.39 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -171.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -43.62 80.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -57.39 -36.33 71.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.414 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -61.81 -62.48 1.77 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.65 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -63.61 -43.21 98.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.157 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.04 -45.13 79.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.75 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -75.24 -42.61 54.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.776 0.322 . . . . 0.0 110.994 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-30 -70.16 -4.15 20.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.509 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -29.39 65.76 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.332 0.587 . . . . 0.0 109.725 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -107.11 -48.02 3.56 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.704 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.628 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.9 m-70 -107.24 102.41 11.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.276 -179.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -68.42 -37.08 79.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.814 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 t70 68.39 -71.63 0.11 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.69 175.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.44 -39.23 3.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.127 -0.558 . . . . 0.0 111.86 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.658 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -63.04 146.54 53.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.876 0.369 . . . . 0.0 110.68 176.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.1 -15.6 56.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.335 177.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -133.42 135.31 44.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.661 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -85.1 152.41 23.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.034 0.445 . . . . 0.0 110.63 -179.179 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 56.6 mt -67.56 101.83 1.06 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.959 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.2 m -91.58 -62.84 1.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.2 p-10 -133.67 147.92 51.45 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -177.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.537 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.3 t -91.13 151.75 3.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.251 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 52.4 t -57.97 124.71 70.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.016 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 9.2 Cg_endo -89.76 178.14 2.44 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 123.39 2.726 . . . . 0.0 112.277 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.4 p . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.434 178.021 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.499 ' HB2' ' CB ' ' A' ' 6' ' ' TYR . 5.9 mm-40 . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.451 ' O ' HG11 ' A' ' 101' ' ' VAL . 28.5 mm-40 -55.0 -29.69 57.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.504 -172.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.408 ' HE3' HG11 ' A' ' 31' ' ' VAL . 9.0 p-90 -96.14 -33.94 11.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CB ' ' HB2' ' A' ' 3' ' ' GLU . 9.8 t80 -79.54 93.64 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.796 -174.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.448 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.9 m-85 -80.74 -21.48 41.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.115 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.57 -158.05 27.11 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.596 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.578 ' HG2' ' HB2' ' A' ' 33' ' ' GLU . 66.5 mttm -79.26 55.14 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.6 pt -78.18 153.69 5.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -83.96 154.14 23.5 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.785 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 13' ' ' ARG . 17.8 ptt85 -56.94 -40.07 75.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -170.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.432 ' N ' ' HG3' ' A' ' 12' ' ' ARG . 22.3 tpp180 -60.54 -35.01 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.63 0.253 . . . . 0.0 110.72 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 46.7 mt-10 -65.56 -40.25 92.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.229 177.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.6 m -66.58 -47.6 72.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.269 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.24 -40.17 96.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.639 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -57.64 -31.99 66.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.277 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 92.0 mt -84.86 -39.66 18.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.397 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 30' ' ' LEU . 60.2 mt -80.77 -27.93 36.58 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.481 HD12 HD13 ' A' ' 54' ' ' LEU . 3.8 mm? -79.83 50.71 1.21 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.669 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -135.99 139.23 29.75 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.49 14.41 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.202 2.601 . . . . 0.0 112.843 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -97.32 -1.74 43.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.44 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 41.2 m-80 -110.34 112.76 56.84 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.358 -177.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 30.2 Cg_endo -65.36 157.0 60.27 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.53 2.153 . . . . 0.0 111.432 175.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -63.13 99.76 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.98 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 138.32 -0.66 2.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.072 -174.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 59.7 m -72.38 124.68 25.64 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 31.7 p90 -132.15 166.07 22.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.14 0.495 . . . . 0.0 112.127 -173.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.516 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -160.3 143.51 13.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.713 170.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.454 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.1 p -107.12 115.44 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.636 0.731 . . . . 0.0 111.171 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 1.6 ptm180 -104.05 157.4 17.14 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.812 177.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.578 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 49.5 mt-10 -96.31 137.68 35.03 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 174.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -82.81 118.11 23.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.604 0.716 . . . . 0.0 109.398 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -62.57 -40.18 96.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.996 -178.741 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -84.98 -65.87 0.96 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.323 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.2 m -77.68 92.09 4.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.439 0.637 . . . . 0.0 110.567 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -82.32 151.98 26.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.756 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.462 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 82.67 14.43 75.78 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -172.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -149.49 113.83 5.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.968 0.413 . . . . 0.0 110.173 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.824 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 22.9 m-85 -92.62 175.41 6.83 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.543 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 43.8 t -135.31 102.93 5.32 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.206 -178.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.454 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -85.62 91.34 8.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 m -86.65 121.23 28.88 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.08 -179.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.9 p -118.72 138.38 49.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.132 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -78.88 120.34 23.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.795 0.807 . . . . 0.0 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 9.5 t70 -107.26 76.06 1.06 Allowed 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.024 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.575 ' HA ' ' HA ' ' A' ' 54' ' ' LEU . 74.3 t80 -77.54 95.15 4.45 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.54 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -95.92 154.95 16.96 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.211 -177.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -84.15 -16.29 44.08 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.355 -173.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.99 -43.74 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.75 0.31 . . . . 0.0 111.165 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -82.69 -37.26 25.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.051 0.453 . . . . 0.0 110.818 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 108.61 -162.85 12.82 Favored Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 -176.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -79.61 104.99 10.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.676 0.751 . . . . 0.0 111.759 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.628 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 10.1 m-80 -102.14 157.18 17.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.322 178.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.0 t -112.79 115.56 50.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.143 0.497 . . . . 0.0 110.259 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -93.52 109.15 20.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.601 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -89.31 98.7 11.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.855 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -92.58 103.45 15.85 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -69.69 125.71 27.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.327 0.584 . . . . 0.0 111.048 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.824 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -91.97 93.9 4.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.38 155.18 23.64 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.023 -173.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 59.8 mtpt -105.43 146.63 29.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.792 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 65' ' ' ASP . 98.4 mt -78.8 -74.22 0.29 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.206 173.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 6.2 p-10 173.2 -44.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.543 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.7 p -136.86 -29.89 0.9 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.899 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.48 -44.76 97.58 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.766 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.42 -147.36 18.57 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.889 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -109.86 152.16 26.12 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.05 0.54 . . . . 0.0 109.684 -177.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -150.52 135.75 17.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.192 0.52 . . . . 0.0 111.305 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.653 HG12 HG12 ' A' ' 61' ' ' ILE . 66.5 mt -92.0 -24.02 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 122.198 0.999 . . . . 0.0 108.469 171.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.4 t -148.71 145.66 27.77 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.348 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -64.97 -21.4 66.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -169.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -86.48 -0.87 56.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.9 m -147.04 108.81 4.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.33 133.47 55.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.197 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -123.02 132.9 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.774 0.321 . . . . 0.0 110.622 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 m -79.45 3.4 18.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.6 m -150.68 132.63 15.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.57 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.7 mt -66.19 -25.32 66.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.682 -177.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -62.7 -46.8 86.45 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -66.67 -32.07 73.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.55 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.601 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -57.56 -65.95 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.302 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -62.54 -43.63 98.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.98 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.175 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -76.74 -43.56 36.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.729 0.3 . . . . 0.0 111.053 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 25.4 m-85 -70.73 -9.09 56.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.608 -177.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.646 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 70.6 m -67.45 -28.39 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.212 0.53 . . . . 0.0 110.013 173.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.49 -48.53 3.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.674 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 56.2 m170 -110.27 116.47 31.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.29 178.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.47 -38.01 65.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.814 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 61.02 -78.98 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.092 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.86 -40.59 5.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.739 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.627 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.17 149.36 50.59 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.956 0.408 . . . . 0.0 110.081 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 59.1 m -76.67 -17.93 58.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.537 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -133.04 134.02 43.83 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -68.95 151.27 46.75 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 74.2 mt -67.79 84.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.202 0.525 . . . . 0.0 109.848 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.8 m -73.82 -58.76 3.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.234 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -139.75 146.84 40.02 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.069 0.461 . . . . 0.0 110.095 -177.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.521 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.5 t -89.31 149.4 4.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.8 -179.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 18' ' ' LEU . 53.2 t -65.68 119.13 57.9 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.155 177.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.5 135.69 26.95 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.588 2.192 . . . . 0.0 112.465 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.0 p . . . . . 0 C--N 1.322 -0.61 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.762 176.917 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.79 85.54 7.28 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 175.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -69.24 108.36 3.62 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.787 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 30.42 -84.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.788 1.635 . . . . 0.0 113.333 -173.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 5.1 p-90 -81.38 -34.78 31.47 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.997 -173.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.56 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 1.0 OUTLIER -86.45 88.45 7.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.083 0.468 . . . . 0.0 110.462 -174.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -75.98 -30.37 58.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.759 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.3 -157.72 14.76 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.737 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -82.49 57.52 3.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.484 0.659 . . . . 0.0 111.466 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.02 134.49 26.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -73.83 165.06 25.79 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.854 -176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' HE ' ' CD ' ' A' ' 16' ' ' GLU . 19.4 ttt180 -54.94 -49.57 71.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.743 -0.208 . . . . 0.0 111.238 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -61.5 -41.32 97.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.609 -175.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -61.57 -42.4 98.8 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.355 0.598 . . . . 0.0 110.019 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.2 t -67.83 -41.21 83.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.085 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.406 ' CD ' ' HE ' ' A' ' 12' ' ' ARG . 49.6 mt-10 -61.53 -42.19 98.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.503 0.192 . . . . 0.0 110.972 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -57.98 -35.37 71.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.334 . . . . 0.0 110.908 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.9 mt -78.13 -40.94 36.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.093 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.804 HD21 HD22 ' A' ' 30' ' ' LEU . 97.2 mt -76.95 -39.21 51.44 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -174.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.01 38.16 0.27 Allowed 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.469 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 23.7 m-80 -89.51 118.75 69.34 Favored Pre-proline 0 C--N 1.322 -0.607 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -55.23 -18.07 17.18 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 123.359 2.706 . . . . 0.0 113.461 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -86.58 -2.26 58.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.533 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.469 ' ND2' ' HB2' ' A' ' 21' ' ' ASN . 95.9 m-20 -84.89 131.89 47.69 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.813 0.339 . . . . 0.0 110.421 177.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -82.64 156.42 16.09 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.705 2.27 . . . . 0.0 111.919 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 33.8 ttp180 -61.64 123.32 17.57 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.096 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.51 -5.0 10.91 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.436 -175.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.577 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 87.0 m -66.06 114.38 5.17 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.908 0.416 . . . . 0.0 110.123 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.53 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 43.2 p90 -128.55 166.7 18.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.755 0.312 . . . . 0.0 111.625 -175.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.804 HD22 HD21 ' A' ' 19' ' ' LEU . 1.7 pt? -169.11 152.03 4.94 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 172.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.489 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.3 p -110.54 119.28 59.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.443 0.64 . . . . 0.0 111.006 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 10.5 ptp85 -102.04 151.32 22.29 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.495 178.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -93.85 117.22 29.81 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -76.71 121.4 23.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.152 0.501 . . . . 0.0 110.946 -174.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -91.98 -16.12 26.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.059 174.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 t -88.73 -13.88 38.54 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.627 0.727 . . . . 0.0 109.582 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.6 m -139.35 93.17 2.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.658 171.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -69.96 141.87 52.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.651 -173.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.54 64.96 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.872 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -142.35 144.2 33.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.027 0.442 . . . . 0.0 110.341 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.604 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.0 m-85 -113.52 172.78 6.76 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.2 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 39.9 t -140.01 112.16 7.64 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.786 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.55 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.4 tm? -85.33 102.34 13.3 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 173.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 t -99.51 124.67 44.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.653 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.8 p -118.22 138.15 49.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.125 0.488 . . . . 0.0 110.58 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.9 m -91.05 105.84 18.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.437 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.478 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 3.7 m-20 -88.8 169.11 11.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.189 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -143.68 123.92 13.78 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.448 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -128.13 135.51 49.88 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -80.94 51.84 1.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.773 0.797 . . . . 0.0 109.772 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.51 -26.29 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.282 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -114.11 -20.34 11.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.342 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.13 -158.32 34.5 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.9 mp -74.32 114.01 12.19 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -122.84 127.52 49.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.346 0.593 . . . . 0.0 110.57 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 98.6 t -86.06 121.37 37.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.056 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.567 ' NZ ' ' HB2' ' A' ' 57' ' ' LYS . 3.4 ttmp? -102.05 110.41 22.37 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.726 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -89.08 99.76 12.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.702 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.411 ' CD2' ' HG ' ' A' ' 94' ' ' LEU . 12.9 m-85 -91.11 142.93 27.22 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 13.0 mmmm -99.42 131.58 45.33 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.925 -172.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.604 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -98.5 98.82 7.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.706 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.464 HH11 ' HD2' ' A' ' 62' ' ' ARG . 54.6 mtt180 -83.21 150.82 25.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.926 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -109.79 128.27 55.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.288 0.566 . . . . 0.0 111.646 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.494 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 79.3 mt -90.37 136.53 33.0 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.73 -12.25 59.95 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.201 0.524 . . . . 0.0 110.851 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -135.43 42.15 2.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.38 177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -159.05 -70.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.804 -178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 156.87 -123.65 1.33 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.276 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -119.91 144.49 47.4 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -175.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.429 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 15.3 p90 -156.94 136.61 12.34 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.214 0.531 . . . . 0.0 110.849 175.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 60' ' ' LYS . 58.8 mt -87.11 -30.21 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.094 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -140.74 157.21 45.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.447 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.4 m -74.69 42.53 0.17 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.252 0.548 . . . . 0.0 111.575 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -125.95 -71.9 0.68 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.546 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.408 HG21 ' CE2' ' A' ' 86' ' ' TYR . 0.2 OUTLIER -96.11 125.6 40.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.959 179.085 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -130.93 131.14 44.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.913 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.594 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 92.9 m-85 -130.9 146.54 52.35 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.705 -175.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.428 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 19.9 m -83.42 3.12 33.3 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 41.2 m -152.06 156.74 40.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.549 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.6 mt -66.38 -43.49 85.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.835 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -58.76 -47.34 85.04 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.841 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.477 ' HB3' ' HB3' ' A' ' 77' ' ' PHE . 20.4 tt0 -56.32 -35.1 67.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.115 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.441 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 7.9 tt -69.56 -60.49 2.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.886 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -60.84 -41.54 89.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -176.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -53.84 -45.79 71.01 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.748 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.408 ' CE2' HG21 ' A' ' 75' ' ' THR . 66.6 t80 -71.57 -46.08 60.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.858 0.361 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.594 ' HE1' ' HE2' ' A' ' 77' ' ' PHE . 2.5 m-85 -66.55 -11.93 55.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.22 -177.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.2 t -72.34 -27.42 62.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 110.344 176.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -104.53 -48.64 3.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.351 0.596 . . . . 0.0 110.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.476 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.7 t-160 -113.54 108.23 16.89 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.36 -37.93 87.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.505 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.3 t70 67.75 -67.03 0.19 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.758 174.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -110.06 -32.26 2.88 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.079 -0.581 . . . . 0.0 112.212 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.2 mp -69.46 155.79 39.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.063 0.458 . . . . 0.0 111.07 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 30.8 m -78.55 -19.43 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.462 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -142.43 135.04 28.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.235 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -74.37 144.85 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.006 0.432 . . . . 0.0 111.174 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.53 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 69.6 mt -56.83 109.76 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.63 -176.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.1 m -98.71 -60.09 1.61 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 -173.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.577 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.7 p-10 -134.63 147.22 50.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.749 -176.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.423 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.1 t -88.37 146.58 6.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -177.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.2 t -55.39 122.07 41.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 O-C-N 123.718 0.636 . . . . 0.0 111.307 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -78.02 136.14 14.51 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.29 1.994 . . . . 0.0 112.086 177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 t -110.61 171.26 7.56 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 10.8 t -140.42 33.09 1.87 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.249 0.547 . . . . 0.0 109.709 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.657 ' HA ' ' HE3' ' A' ' 106' ' ' LYS . 0.9 OUTLIER . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.486 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 121.787 0.803 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.9 53.39 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.394 -1.275 . . . . 0.0 107.788 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.91 140.29 58.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.823 -166.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -52.64 -39.45 61.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.506 -1.224 . . . . 0.0 113.423 -168.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -66.08 -33.35 75.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 79.2 t80 -83.47 99.93 10.42 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.776 0.322 . . . . 0.0 110.378 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.466 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.6 m-85 -83.68 -24.07 31.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.201 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.13 -166.14 13.35 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.86 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 44.6 pttt -86.69 78.81 9.05 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.632 0.73 . . . . 0.0 111.324 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 pt -97.79 149.81 4.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -76.53 171.01 15.33 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.83 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 64.0 mtp180 -58.18 -47.81 82.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.811 -0.177 . . . . 0.0 111.109 177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.462 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 45.5 mtp180 -56.66 -41.6 77.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.166 -177.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.88 -52.86 46.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.063 0.458 . . . . 0.0 110.531 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 6.9 m -62.14 -55.1 32.19 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.553 -174.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.418 ' HG2' HG21 ' A' ' 56' ' ' VAL . 34.4 mt-10 -71.88 -22.51 61.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.094 -173.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.576 ' HG3' ' HE2' ' A' ' 106' ' ' LYS . 8.4 tpt180 -76.33 -23.23 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.059 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.0 mt -88.85 -21.57 23.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.829 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.622 HD21 HD22 ' A' ' 30' ' ' LEU . 80.2 mt -93.88 -31.87 14.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.822 -178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.426 ' HA ' HD13 ' A' ' 20' ' ' LEU . 3.5 mm? -77.66 53.35 1.09 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.145 0.498 . . . . 0.0 111.298 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.523 ' HB2' ' OD1' ' A' ' 24' ' ' ASN . 87.3 m-20 -113.63 128.97 25.12 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 173.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.91 -12.2 21.3 Favored 'Trans proline' 0 N--CA 1.471 0.191 0 C-N-CA 122.843 2.362 . . . . 0.0 112.866 -177.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -83.72 -33.63 25.07 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.796 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.523 ' OD1' ' HB2' ' A' ' 21' ' ' ASN . 4.3 m-20 -54.12 116.89 11.37 Favored Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.549 -178.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.96 151.44 24.1 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.487 2.124 . . . . 0.0 112.061 177.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -55.49 116.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.408 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.53 -2.89 9.49 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.804 -0.713 . . . . 0.0 111.958 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.503 ' HB ' ' HB2' ' A' ' 46' ' ' SER . 46.3 m -73.05 121.86 20.83 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 175.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -134.9 159.11 42.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.036 0.446 . . . . 0.0 111.873 -175.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.622 HD22 HD21 ' A' ' 19' ' ' LEU . 2.3 pt? -155.59 137.35 14.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.97 170.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG13 ' HA ' ' A' ' 6' ' ' TYR . 1.4 p -99.8 114.48 38.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.717 0.77 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 ptt85 -115.11 160.17 19.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.575 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.663 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.9 tt0 -99.78 139.75 34.99 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.508 ' HB3' HG22 ' A' ' 36' ' ' THR . 45.6 m -100.11 115.77 30.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.292 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -64.32 -17.26 63.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.009 -174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.508 HG22 ' HB3' ' A' ' 34' ' ' SER . 10.6 t -61.47 -22.17 64.83 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.713 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.0 m -151.49 102.08 2.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.511 ' NZ ' ' HB2' ' A' ' 38' ' ' LYS . 4.4 ttmp? -55.61 113.36 1.42 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.095 -177.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.97 -2.2 48.01 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.612 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -100.01 112.96 25.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.793 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 75.5 m-85 -96.43 161.88 13.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.075 -177.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.53 117.7 19.12 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.83 176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -82.38 85.6 6.86 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.411 ' O ' HD23 ' A' ' 30' ' ' LEU . 19.2 m -74.46 111.9 10.11 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.907 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.8 p -107.86 136.86 41.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.006 0.431 . . . . 0.0 110.742 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.503 ' HB2' ' HB ' ' A' ' 28' ' ' THR . 15.4 m -81.04 107.55 13.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.875 176.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -102.86 147.87 26.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.849 179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.559 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 88.1 t80 -133.46 113.7 12.8 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.404 0.621 . . . . 0.0 110.534 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -96.68 139.47 32.7 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.667 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -81.48 49.83 1.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.107 0.48 . . . . 0.0 110.281 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -171.32 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.537 -178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -105.2 5.81 32.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.667 -175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.02 -146.62 38.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.138 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.559 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.1 mp -96.29 147.0 24.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 0.0 110.891 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -143.67 154.56 43.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.399 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.418 HG21 ' HG2' ' A' ' 16' ' ' GLU . 84.1 t -108.15 120.01 58.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 120.976 0.417 . . . . 0.0 111.078 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -102.14 114.42 28.54 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.688 175.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -89.71 86.04 6.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.052 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.408 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 49.9 m-85 -69.0 129.24 39.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.838 0.351 . . . . 0.0 110.805 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 38.9 mmtm -75.03 122.24 23.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.505 -172.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 59.2 mt -107.29 87.24 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -110.74 163.17 14.03 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.496 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 36.3 mtmm -99.29 150.17 22.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.34 0.59 . . . . 0.0 111.73 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.511 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 68.7 mt -95.56 177.11 5.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.79 -1.095 . . . . 0.0 109.993 172.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -51.23 -58.16 6.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.437 0.46 . . . . 0.0 110.897 175.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 p -142.21 14.43 2.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.045 0.45 . . . . 0.0 111.547 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -84.71 -32.96 20.33 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.348 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 110.19 -144.61 17.01 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.829 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -93.92 143.26 26.51 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.511 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 13.1 p90 -154.86 139.63 17.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.933 0.397 . . . . 0.0 110.74 177.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.65 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 62.1 mt -97.12 -26.27 4.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 122.071 0.939 . . . . 0.0 108.505 171.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.479 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.3 t -136.37 144.04 44.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.069 -1.423 . . . . 0.0 108.678 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.3 m -68.82 -15.74 63.59 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -170.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HD2' ' OD1' ' A' ' 92' ' ' ASP . 61.5 mtt85 -71.32 -58.74 3.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 0.0 110.874 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.42 HG21 ' CE1' ' A' ' 86' ' ' TYR . 25.1 m -102.54 124.08 47.45 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.28 -175.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -124.93 137.29 54.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.829 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -137.53 135.75 37.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.669 0.271 . . . . 0.0 110.784 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.0 m -88.38 14.18 10.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.152 0.501 . . . . 0.0 110.702 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 29.0 m -143.65 132.05 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.784 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.449 ' O ' HG22 ' A' ' 84' ' ' VAL . 88.6 mt -66.93 -25.29 66.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.06 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.45 -48.11 79.09 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.95 -32.8 74.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.524 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -54.67 -64.8 0.72 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.534 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -66.64 -40.8 87.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.089 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.55 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.924 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.42 ' CE1' HG21 ' A' ' 75' ' ' THR . 60.9 t80 -93.04 -47.33 7.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.696 0.284 . . . . 0.0 111.04 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.65 ' HE2' ' HB ' ' A' ' 71' ' ' ILE . 2.8 m-85 -68.75 -9.0 48.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.035 -175.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.649 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 5.8 p -72.69 -33.37 66.46 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.374 0.607 . . . . 0.0 110.33 174.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -100.86 -39.83 7.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.678 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 34.3 m170 -115.47 111.99 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.93 -33.81 64.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.993 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.492 ' OD1' ' HD2' ' A' ' 74' ' ' ARG . 9.8 t70 62.9 -81.71 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.566 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -101.23 -32.0 5.4 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 121.237 -0.506 . . . . 0.0 112.088 -178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.615 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -68.6 152.51 45.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 74.1 m -90.75 13.13 17.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 109.851 174.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -140.18 134.39 31.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.653 -175.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -97.78 120.22 37.78 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 175.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 63.9 mt -52.25 106.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 111.201 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.2 m -98.8 -58.47 1.94 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.269 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 p30 -135.45 151.95 50.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -90.23 146.41 6.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 120.773 0.32 . . . . 0.0 110.191 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 49.8 t -52.56 133.93 44.84 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.821 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.9 Cg_exo -65.9 135.73 42.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.796 2.331 . . . . 0.0 111.011 173.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -13.91 61.16 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -177.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 62.7 m -136.26 135.2 38.8 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.23 0.538 . . . . 0.0 111.618 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.576 ' HE2' ' HG3' ' A' ' 17' ' ' ARG . 22.6 pttp . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.656 175.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 121.28 0.562 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.12 76.28 1.32 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.196 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -82.09 -172.53 4.0 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.327 -172.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.444 ' O ' HG11 ' A' ' 101' ' ' VAL . 15.6 mm-40 -50.11 -51.91 39.2 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.604 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.535 ' CD1' HG21 ' A' ' 84' ' ' VAL . 1.2 p-90 -84.61 -23.71 29.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.163 -173.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.432 ' HA ' HG13 ' A' ' 31' ' ' VAL . 23.0 t80 -85.18 106.73 16.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.552 -173.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -86.6 -21.75 26.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.878 0.37 . . . . 0.0 111.098 -177.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.08 -163.57 12.35 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.48 -0.867 . . . . 0.0 113.489 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -83.84 56.63 3.75 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.817 0.447 . . . . 0.0 111.219 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.538 ' O ' ' HD2' ' A' ' 32' ' ' ARG . 39.5 pt -90.41 139.21 17.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.084 0.468 . . . . 0.0 110.092 177.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -78.76 177.56 8.58 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.755 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -55.26 -46.82 76.09 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -177.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -56.12 -48.5 76.08 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.787 -177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -59.9 -36.12 76.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.241 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -64.38 -52.83 56.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.82 0.343 . . . . 0.0 110.449 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -70.11 -29.28 66.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.648 -179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -57.75 -40.01 78.7 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.019 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.2 mt -88.04 -31.15 19.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.873 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.55 HD21 HD22 ' A' ' 30' ' ' LEU . 59.9 mt -82.39 -30.65 30.08 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -172.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' HA ' HD13 ' A' ' 20' ' ' LEU . 1.9 mm? -77.52 26.65 0.17 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.241 0.473 . . . . 0.0 112.216 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -99.17 120.03 59.21 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.21 -3.63 4.25 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 C-N-CA 123.42 2.747 . . . . 0.0 114.034 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -77.57 -12.68 59.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.467 . . . . 0.0 110.463 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -83.83 124.65 74.63 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.998 -178.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.89 151.01 27.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.56 2.173 . . . . 0.0 112.232 175.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -56.28 113.46 1.58 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.687 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.55 10.04 8.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.192 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 88.2 m -83.35 114.89 21.73 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.301 0.24 . . . . 0.0 110.454 176.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.467 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 39.6 p90 -122.5 162.51 21.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 111.259 -175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.55 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -159.18 128.48 5.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.541 172.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.468 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 p -94.97 121.06 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.759 0.79 . . . . 0.0 110.659 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 38.3 ptt85 -108.69 160.1 16.22 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.794 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -92.71 135.96 33.65 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.2 t -97.38 101.06 12.52 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 172.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.35 -34.8 58.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.942 -171.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.8 p -86.49 19.3 2.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -173.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.505 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 26.5 m -152.2 124.29 8.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.963 0.411 . . . . 0.0 110.087 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -70.32 104.75 2.77 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.611 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.93 5.78 65.89 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.083 174.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.505 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -95.07 113.86 25.6 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.276 0.56 . . . . 0.0 110.312 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 71.9 m-85 -104.76 169.23 8.57 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.227 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.3 m -133.51 108.88 8.89 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.961 0.41 . . . . 0.0 110.542 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -83.07 84.77 7.34 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.5 t -81.27 127.82 33.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.383 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 13.9 p -125.61 138.61 53.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.0 t -78.25 119.45 21.64 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.725 0.774 . . . . 0.0 110.293 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -95.78 153.48 17.72 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.181 -1.372 . . . . 0.0 108.591 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -135.89 107.74 7.08 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.429 -0.508 . . . . 0.0 110.957 -175.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -90.77 139.81 30.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 173.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -84.13 -2.04 56.07 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -172.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -120.21 -51.22 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -84.62 -25.81 28.3 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.588 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.22 -166.69 12.17 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.081 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.623 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.5 pt? -79.3 146.25 33.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.104 0.478 . . . . 0.0 111.496 -178.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -137.12 178.18 7.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.148 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 99.3 t -121.97 128.73 75.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.024 0.44 . . . . 0.0 110.306 177.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.4 tttp -111.26 95.53 5.58 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.547 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.9 m-70 -76.94 91.58 3.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.458 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.489 ' HB3' HG23 ' A' ' 71' ' ' ILE . 70.4 m-85 -78.18 137.06 37.96 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -104.82 133.68 49.24 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.145 0.498 . . . . 0.0 110.982 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 71' ' ' ILE . 66.6 mt -104.23 96.38 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.103 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.7 ttp180 -88.22 134.69 33.72 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.969 0.414 . . . . 0.0 110.421 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -82.42 127.73 33.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.773 177.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.7 mt -99.64 115.33 29.18 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.237 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.01 -25.74 67.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.326 0.584 . . . . 0.0 110.089 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -99.29 11.43 39.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.239 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.51 -102.43 0.18 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.955 -178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -161.78 -136.38 1.99 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.25 -176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -114.39 138.61 50.33 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.413 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 13.7 p90 -147.91 143.33 27.29 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.102 0.477 . . . . 0.0 110.959 177.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.75 HG12 HG12 ' A' ' 61' ' ' ILE . 57.9 mt -95.75 -36.76 6.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.159 174.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.01 148.18 52.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.365 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.454 ' O ' ' HD2' ' A' ' 74' ' ' ARG . 14.4 p -78.91 47.04 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -172.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 73' ' ' SER . 30.6 mmm180 -125.44 -62.72 1.19 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.4 m -108.93 133.4 53.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.63 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.413 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 72.6 mt-30 -129.17 135.22 48.56 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.538 0.209 . . . . 0.0 110.501 -178.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -121.11 155.38 34.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.874 0.369 . . . . 0.0 110.867 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.4 p -93.41 -7.72 43.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 31.7 p -132.51 139.29 47.85 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.995 0.426 . . . . 0.0 110.146 177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.646 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.4 mt -68.47 -26.56 65.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.915 -178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -62.8 -47.3 84.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -71.23 -29.91 65.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.334 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.604 HD11 HD11 ' A' ' 71' ' ' ILE . 3.1 tm? -56.88 -62.23 1.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.045 176.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.8 m -64.35 -44.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.05 -46.28 71.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.74 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -73.78 -39.88 63.83 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.258 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 6.6 m-85 -74.0 -3.73 31.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.112 0.482 . . . . 0.0 111.536 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -82.26 -27.06 32.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 170.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.1 mttm -96.24 -49.91 5.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.807 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.618 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 35.1 m170 -125.53 119.29 27.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.2 174.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -70.45 -17.59 62.99 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.6 t70 66.55 -72.15 0.09 Allowed 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.846 0.716 . . . . 0.0 111.193 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -116.31 -33.68 1.44 Allowed Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.623 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.4 mp -61.69 169.78 2.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.256 0.551 . . . . 0.0 111.057 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 41.8 t -116.35 -22.75 8.66 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.135 -177.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 97' ' ' ARG . 53.3 m80 -87.42 -32.02 19.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.202 -170.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 96' ' ' HIS . 49.5 mtp180 66.82 124.82 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.556 0.535 . . . . 0.0 110.018 -168.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 82.5 mt -61.03 104.45 0.37 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.607 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.6 m -96.02 -66.02 0.93 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.304 -173.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.9 p30 -133.02 150.13 52.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.51 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.7 t -89.91 145.72 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.1 t -46.33 130.38 7.77 Favored Pre-proline 0 C--O 1.234 0.256 0 O-C-N 123.99 0.807 . . . . 0.0 112.308 -176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.45 151.5 82.94 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.043 2.495 . . . . 0.0 111.916 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.9 p -88.2 137.84 31.97 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.573 179.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.9 p -91.65 16.11 11.27 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.113 0.482 . . . . 0.0 110.766 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 117.941 -1.028 . . . . 0.0 108.889 -177.821 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 N--CA 1.482 1.171 0 CA-C-O 121.403 0.62 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 176.82 50.88 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.389 -1.278 . . . . 0.0 108.144 -173.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.28 153.56 30.35 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.515 -1.221 . . . . 0.0 110.599 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -45.01 -48.44 11.57 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.49 ' HE3' HG11 ' A' ' 31' ' ' VAL . 7.7 p-90 -81.84 -43.03 18.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.651 0.262 . . . . 0.0 111.447 -178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.423 ' HA ' HG13 ' A' ' 31' ' ' VAL . 1.9 t80 -85.68 87.41 7.4 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.359 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.48 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 7.7 m-85 -67.04 -41.15 87.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.822 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.32 -165.61 18.41 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.752 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 pttm -84.29 73.65 10.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.506 0.669 . . . . 0.0 111.587 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.8 pt -94.61 144.99 8.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.986 175.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.5 p -84.23 177.53 8.16 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.244 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.468 ' HB3' ' OE2' ' A' ' 16' ' ' GLU . 25.1 mtp180 -56.08 -50.15 71.8 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.476 0.176 . . . . 0.0 111.476 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 13' ' ' ARG . 52.9 mtp180 -52.86 -37.51 60.43 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.365 -178.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -79.45 -47.57 15.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.1 m -61.38 -49.24 77.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.984 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.468 ' OE2' ' HB3' ' A' ' 12' ' ' ARG . 42.1 mt-10 -68.27 -30.02 68.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.978 -177.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 -59.89 -52.01 67.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.039 0.447 . . . . 0.0 110.858 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.522 HD22 ' OG1' ' A' ' 104' ' ' THR . 79.0 mt -70.12 -33.8 72.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.512 -174.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.771 HD21 HD22 ' A' ' 30' ' ' LEU . 55.1 mt -79.76 -32.9 41.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mp -81.27 8.78 8.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.79 0.328 . . . . 0.0 111.327 177.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.848 HD22 ' HG2' ' A' ' 23' ' ' GLU . 7.0 t30 -67.52 126.68 92.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 175.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.54 23.66 0.17 Allowed 'Trans proline' 0 N--CA 1.478 0.597 0 C-N-CA 123.493 2.795 . . . . 0.0 115.514 -167.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.848 ' HG2' HD22 ' A' ' 21' ' ' ASN . 11.3 pt-20 -122.34 10.35 9.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.312 0.577 . . . . 0.0 110.063 176.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -96.83 122.12 57.62 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.274 -177.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -86.72 169.58 7.89 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.898 2.399 . . . . 0.0 111.758 173.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -61.89 112.2 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.591 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.69 2.8 6.68 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.399 -177.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 35.1 m -80.42 118.51 22.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CG ' HD22 ' A' ' 98' ' ' LEU . 28.7 p90 -129.78 165.83 21.14 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -173.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.771 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -164.64 145.84 8.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.3 171.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.49 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -108.15 124.45 64.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.328 0.585 . . . . 0.0 110.961 178.704 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.571 ' HG2' ' HB3' ' A' ' 42' ' ' CYS . 5.2 ptp180 -102.25 158.3 16.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.224 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -91.29 101.38 14.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 40' ' ' ALA . 34.5 t -73.93 111.78 9.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.111 0.481 . . . . 0.0 110.827 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.19 59.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 175.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 m -64.44 -36.33 83.83 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.813 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.9 m -147.6 109.46 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.325 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.59 132.84 53.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 92.01 1.74 69.76 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.827 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.543 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . -125.27 116.26 21.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.018 0.437 . . . . 0.0 109.864 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 90.4 m-85 -97.05 176.49 5.93 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.571 ' HB3' ' HG2' ' A' ' 32' ' ' ARG . 41.2 t -135.45 112.78 10.57 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.761 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.1 tm? -87.05 88.31 7.67 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 174.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 15.4 m -82.35 116.11 21.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.968 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 p -110.51 130.89 63.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.082 0.468 . . . . 0.0 110.038 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.497 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 41.4 t -78.24 122.58 25.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.341 177.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -116.87 123.68 47.63 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.943 -174.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.507 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 51.9 t80 -101.84 72.82 1.37 Allowed 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 176.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.54 ' HB2' ' HG2' ' A' ' 52' ' ' LYS . 15.5 m-20 -61.1 124.45 20.58 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.633 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.447 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -75.26 53.1 0.63 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.567 0.699 . . . . 0.0 110.834 -179.456 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -162.22 -51.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.742 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.54 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 10.0 ptpp? -99.28 -23.58 15.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.173 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 97.89 -158.72 20.78 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.366 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 35.4 mt -64.55 120.67 12.78 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.403 0.621 . . . . 0.0 111.343 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.442 ' ND2' ' HD2' ' A' ' 52' ' ' LYS . 8.1 p30 -143.1 146.35 33.7 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.453 176.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.3 t -89.14 119.71 36.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 177.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HZ2' ' HB2' ' A' ' 57' ' ' LYS . 3.5 ttmp? -95.99 100.81 12.44 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 50.8 m-70 -80.07 89.84 5.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.303 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -78.5 142.85 37.12 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -115.01 117.38 30.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.178 0.514 . . . . 0.0 110.76 -172.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.683 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 63.5 mt -87.86 92.74 3.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.792 -178.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -100.2 144.01 29.73 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.911 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.67 157.77 19.0 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.791 -0.363 . . . . 0.0 110.056 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.415 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 7.7 mt -70.1 -91.69 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.956 176.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -134.16 -34.37 0.98 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.6 t -149.07 -31.13 0.24 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.068 178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.48 68.57 0.36 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 119.51 -1.329 . . . . 0.0 113.519 -172.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -178.28 94.6 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.758 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -83.05 125.41 31.43 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.437 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 15.8 p90 -126.06 132.72 51.89 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.498 0.666 . . . . 0.0 111.768 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.63 HG21 HD11 ' A' ' 94' ' ' LEU . 65.4 mt -93.35 -39.69 11.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 168.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.7 t -121.16 179.79 4.29 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.891 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.0 t -73.18 -43.74 60.94 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -69.54 -56.71 6.58 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -170.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.451 ' HB ' ' CE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.68 120.59 32.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -169.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.437 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 2.2 mp0 -111.99 131.8 55.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.788 170.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.462 ' CE2' ' HE1' ' A' ' 87' ' ' TYR . 98.9 m-85 -123.28 131.34 53.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.636 0.255 . . . . 0.0 110.465 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.29 5.23 27.54 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.86 0.362 . . . . 0.0 111.783 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.1 m -147.7 137.54 22.74 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.961 0.41 . . . . 0.0 110.404 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.592 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.8 mt -72.75 -30.13 63.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.427 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -48.5 81.55 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -62.79 -35.72 80.79 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.565 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 HD11 ' A' ' 71' ' ' ILE . 2.8 tm? -58.34 -60.94 2.99 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.825 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -65.17 -44.13 95.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -176.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.48 -39.6 70.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.876 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -73.76 -48.52 31.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.592 0.235 . . . . 0.0 111.018 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 2.4 m-30 -69.99 -10.79 59.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.356 -177.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.513 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 10.7 t -70.28 -19.57 63.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.247 0.546 . . . . 0.0 110.132 176.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -116.15 -52.41 2.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.852 177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.517 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.1 t-160 -116.8 103.48 10.37 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.485 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -68.81 -27.34 65.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.73 -177.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.5 t70 70.11 -73.74 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.5 174.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.46 -49.57 2.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.794 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.74 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.3 mp -60.85 144.57 52.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.069 0.461 . . . . 0.0 110.643 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.9 t -74.6 -39.13 62.38 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -89.56 121.59 31.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.142 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.653 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -81.61 146.65 29.98 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.588 HD22 ' CG ' ' A' ' 29' ' ' PHE . 73.9 mt -69.04 85.68 0.35 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.218 0.532 . . . . 0.0 110.416 -177.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 7.7 m -78.17 -58.7 3.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.335 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.453 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.7 p-10 -132.94 143.74 49.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.949 -177.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.488 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -82.7 152.27 4.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.78 140.15 81.44 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.31 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.12 176.47 3.84 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.67 2.247 . . . . 0.0 111.167 172.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.522 ' OG1' HD22 ' A' ' 18' ' ' LEU . 24.0 p 57.39 -175.81 0.07 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.463 0.705 . . . . 0.0 110.797 -173.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.436 ' HA ' ' CE2' ' A' ' 7' ' ' PHE . 23.0 p -154.97 -10.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 0.0 111.159 175.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.421 ' H ' ' H ' ' A' ' 105' ' ' SER . 24.7 ttpp . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.216 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 120.943 0.402 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -112.02 119.99 40.34 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.436 173.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 52.8 mm-40 -79.09 178.41 8.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.065 -176.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -61.55 -52.46 64.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.002 0.429 . . . . 0.0 110.066 175.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 14.9 p-90 -79.79 -41.06 27.27 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.038 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.576 ' HE1' ' CE2' ' A' ' 41' ' ' TYR . 80.0 t80 -85.66 95.57 9.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.929 -177.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.583 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 30.6 m-85 -79.92 -20.96 44.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.209 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.76 -164.34 21.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.974 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 7.3 pttm -81.72 74.95 8.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.117 0.484 . . . . 0.0 111.846 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.678 HG13 ' HD2' ' A' ' 32' ' ' ARG . 39.4 pt -97.41 145.21 9.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 169.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.3 p -75.08 165.68 24.85 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.447 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 57.9 mtm180 -56.84 -51.0 70.72 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 123.104 0.252 . . . . 0.0 110.468 -176.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -49.48 -48.85 47.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.661 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -59.55 -47.58 84.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.299 0.571 . . . . 0.0 110.335 179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 45.2 t -64.29 -47.3 80.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.326 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.496 ' HA ' HG21 ' A' ' 56' ' ' VAL . 48.3 mt-10 -68.96 -34.75 75.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.589 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.4 -25.05 68.11 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.126 0.489 . . . . 0.0 110.336 177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 95.3 mt -88.07 -39.37 14.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.519 178.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.539 HD21 HD22 ' A' ' 30' ' ' LEU . 88.4 mt -77.02 -25.46 52.64 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.4 mm? -77.54 4.4 11.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.6 t30 -83.14 109.77 19.41 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.1 Cg_exo -65.67 14.39 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.883 3.055 . . . . 0.0 114.409 -170.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -83.54 -3.67 57.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.785 0.326 . . . . 0.0 110.51 176.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -110.96 143.22 27.84 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.541 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -82.0 164.41 17.7 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 123.09 2.527 . . . . 0.0 112.458 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.498 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 54.4 ttp180 -68.82 106.25 2.62 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.868 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.93 2.92 2.08 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.283 -0.727 . . . . 0.0 111.283 -174.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 68.8 m -76.64 132.46 39.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.198 -0.501 . . . . 0.0 109.757 175.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.564 ' CG ' HD22 ' A' ' 98' ' ' LEU . 31.0 p90 -137.04 166.33 23.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.158 0.504 . . . . 0.0 112.002 -175.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.583 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.3 pt? -162.51 141.9 9.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.391 170.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.75 118.16 55.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.502 0.668 . . . . 0.0 110.666 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.678 ' HD2' HG13 ' A' ' 10' ' ' ILE . 11.3 mtm180 -104.58 162.07 13.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.179 -177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.653 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 37.2 tt0 -97.63 129.91 44.69 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 174.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.2 m -67.85 140.98 56.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.519 0.676 . . . . 0.0 111.317 -176.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.74 -38.5 91.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.83 -177.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.6 p -103.21 -66.65 0.93 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.563 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.2 m -70.74 99.33 1.69 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.152 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -78.25 133.35 37.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.945 0.402 . . . . 0.0 109.923 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.69 -11.16 61.06 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -173.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.553 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -104.15 126.46 51.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.576 ' CE2' ' HE1' ' A' ' 6' ' ' TYR . 60.3 m-85 -117.34 143.33 46.07 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.175 0.512 . . . . 0.0 111.09 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 69.7 m -99.16 94.13 6.34 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.978 -176.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.723 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.2 tm? -81.24 98.38 8.07 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 172.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.7 m -97.86 132.83 43.11 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.729 -175.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.535 HG21 HD23 ' A' ' 94' ' ' LEU . 3.0 t -112.61 139.44 37.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.927 -177.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.402 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 78.6 p -77.41 96.73 4.74 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.708 0.766 . . . . 0.0 109.388 174.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.81 138.81 31.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.596 -174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.498 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 79.7 t80 -122.59 122.45 38.88 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.302 0.572 . . . . 0.0 110.972 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -106.59 152.53 23.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.146 173.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -84.13 -1.92 55.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.746 0.307 . . . . 0.0 111.289 -173.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -123.2 -44.64 2.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.883 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -82.06 -25.52 34.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.164 -177.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.76 -141.58 17.25 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.815 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 78.5 mt -82.86 137.5 34.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.249 0.547 . . . . 0.0 111.322 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -146.4 154.83 42.08 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.496 HG21 ' HA ' ' A' ' 16' ' ' GLU . 58.3 t -97.83 115.56 38.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.966 -178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -89.98 105.72 18.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.679 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -86.7 107.26 18.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.885 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.619 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 4.0 m-85 -95.85 135.0 38.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.959 0.409 . . . . 0.0 110.713 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -95.34 102.7 14.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 71' ' ' ILE . 54.8 mt -82.24 87.01 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.1 mtm180 -86.01 156.07 20.6 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -107.94 155.49 20.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.297 0.57 . . . . 0.0 111.328 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 95.7 mt -108.18 141.21 40.27 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.912 -1.04 . . . . 0.0 108.868 172.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -64.3 -25.42 68.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.6 t -135.44 45.03 2.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.099 0.476 . . . . 0.0 110.13 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -154.09 -77.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 161.44 -157.03 28.62 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.005 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.459 ' HB3' ' CG2' ' A' ' 61' ' ' ILE . 73.5 m-85 -99.36 136.28 39.53 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.505 ' HB3' ' HG2' ' A' ' 76' ' ' GLN . 52.3 p90 -140.04 137.65 34.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.243 0.544 . . . . 0.0 111.078 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.969 HG12 HG12 ' A' ' 61' ' ' ILE . 45.2 mt -82.63 -26.73 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.898 0.856 . . . . 0.0 109.385 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' HB2' ' A' ' 74' ' ' ARG . 8.8 t -155.59 167.87 28.98 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.269 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 6.9 t -80.71 54.39 2.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.686 0.755 . . . . 0.0 109.738 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.602 ' HB2' HG23 ' A' ' 72' ' ' THR . 13.7 mmm180 -126.34 -78.64 0.59 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.539 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.0 m -105.04 131.72 52.19 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.505 ' HG2' ' HB3' ' A' ' 70' ' ' TYR . 73.9 mt-30 -126.43 125.62 42.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.759 0.314 . . . . 0.0 110.8 -176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -121.54 141.11 51.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.312 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -78.49 -0.92 31.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.508 -174.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.6 m -153.48 161.38 42.31 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.414 ' O ' HG22 ' A' ' 84' ' ' VAL . 96.0 mt -81.21 -19.8 42.46 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -168.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.6 tp60 -68.2 -45.19 74.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.648 HE21 ' HA ' ' A' ' 82' ' ' GLN . 0.0 OUTLIER -59.48 -32.86 70.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.898 175.059 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.474 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -59.64 -63.92 1.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.413 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.428 HG22 ' H ' ' A' ' 84' ' ' VAL . 0.1 OUTLIER -64.16 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -176.338 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.72 -32.87 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -90.42 -44.58 9.55 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.223 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.584 ' HD2' HD13 ' A' ' 94' ' ' LEU . 16.1 m-85 -74.6 -7.16 52.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 23.0 p -79.26 -21.39 46.2 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.156 0.503 . . . . 0.0 109.707 172.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 tppp? -100.96 -47.82 4.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.057 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 93.3 m-70 -127.14 117.79 23.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.89 -0.596 . . . . 0.0 109.446 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.56 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -67.55 -29.77 69.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.076 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.5 t70 64.75 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.561 0.538 . . . . 0.0 112.442 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -93.53 -34.84 6.44 Favored Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 177.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.646 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.0 mp -72.14 159.08 34.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.33 -0.435 . . . . 0.0 110.204 174.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 18.3 t -103.54 2.4 33.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.763 0.792 . . . . 0.0 108.877 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 -123.91 112.05 16.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.311 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.9 ptt180 -68.49 136.48 53.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.4 mt -60.33 97.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.376 0.423 . . . . 0.0 109.977 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 11.2 m -89.68 -46.9 8.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.076 0.465 . . . . 0.0 111.291 -172.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.5 p-10 -146.92 154.17 40.98 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.703 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.9 t -91.62 155.37 3.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -177.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 43.2 t -54.3 120.22 24.61 Favored Pre-proline 0 C--O 1.236 0.347 0 O-C-N 123.535 0.522 . . . . 0.0 111.865 -177.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.9 Cg_exo -69.58 139.35 40.63 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.852 2.368 . . . . 0.0 111.383 175.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 p -106.47 131.44 53.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.1 t -73.58 102.22 3.82 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? . . . . . 0 C--O 1.248 0.997 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.712 -175.846 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.35 0.595 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.15 118.4 30.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.104 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -70.2 154.23 42.16 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.449 -177.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -76.65 -42.94 40.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.525 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -75.26 -37.0 61.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.301 -172.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -86.35 105.23 16.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 0.0 110.68 -175.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.493 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 22.7 m-85 -90.8 -11.41 39.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.32 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 91.74 -158.21 24.98 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.674 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.84 66.03 4.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -176.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.4 pt -96.84 141.92 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.6 p -84.99 170.35 13.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.913 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.1 mtp180 -54.43 -51.06 66.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.702 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 35.7 ttp180 -53.37 -40.23 64.82 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.511 0.507 . . . . 0.0 110.793 -177.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -68.19 -53.61 23.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.498 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.2 m -61.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.235 -177.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.19 -24.04 63.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.208 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 38.6 ttp-105 -62.8 -37.97 88.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.789 176.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 84.2 mt -81.31 -33.71 32.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.17 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.677 HD21 HD22 ' A' ' 30' ' ' LEU . 92.2 mt -78.87 -31.55 45.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -172.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.61 10.64 3.74 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 5.4 m-20 -86.55 125.36 67.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-O 120.716 0.294 . . . . 0.0 110.329 175.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 14.3 Cg_exo -69.88 8.48 0.79 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.3 2.667 . . . . 0.0 112.57 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -82.43 -15.6 52.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.779 177.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -92.34 133.5 29.82 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.945 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.448 ' HG2' ' ND2' ' A' ' 100' ' ' ASN . 57.5 Cg_endo -73.61 144.28 35.44 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.858 2.372 . . . . 0.0 111.631 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.589 ' HD3' ' O ' ' A' ' 48' ' ' PHE . 43.6 ttp180 -52.68 114.35 1.37 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.486 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.58 7.07 6.39 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.432 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.562 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 51.7 m -72.19 116.43 12.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.645 0.259 . . . . 0.0 110.872 176.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.539 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.8 p90 -126.61 165.99 18.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.926 0.393 . . . . 0.0 111.203 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.677 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -164.0 142.49 7.48 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 171.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.4 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -106.68 124.24 62.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.674 0.75 . . . . 0.0 110.775 -179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 15.8 ptt180 -115.14 147.69 39.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.249 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -78.7 121.58 24.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.131 177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.8 m -96.62 119.72 35.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.271 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.55 -22.71 40.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.073 -174.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.0 m -69.37 -21.88 63.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.009 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 39' ' ' GLY . 97.4 m -149.92 120.3 7.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.451 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -81.16 15.22 1.99 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.206 0.527 . . . . 0.0 111.34 -176.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.632 ' H ' HG22 ' A' ' 37' ' ' THR . . . -134.2 22.48 3.77 Favored Glycine 0 C--N 1.307 -1.048 0 CA-C-N 115.469 -0.787 . . . . 0.0 112.065 -176.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.35 108.75 2.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.791 0.329 . . . . 0.0 111.339 -178.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.688 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 35.3 m-85 -85.93 152.77 22.69 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 170.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.463 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -109.79 105.81 15.17 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.674 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -90.33 91.82 8.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 173.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -87.48 107.83 18.75 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.973 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.1 p -108.15 130.69 60.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 120.993 0.425 . . . . 0.0 110.475 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 42.7 t -87.36 124.2 33.13 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.628 0.727 . . . . 0.0 109.918 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.424 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 12.3 t70 -120.42 135.41 55.05 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.093 -176.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.589 ' O ' ' HD3' ' A' ' 26' ' ' ARG . 75.0 t80 -116.74 149.07 40.48 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.801 -178.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.519 ' HB3' ' HB3' ' A' ' 52' ' ' LYS . 16.7 t70 -140.93 146.37 37.31 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -73.4 -13.87 61.16 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.3 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.52 -37.67 2.75 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 6.9 ttpm? -83.87 -25.23 30.42 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 120.862 0.363 . . . . 0.0 111.358 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.68 -164.98 34.75 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.929 178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.9 mt -76.45 139.23 40.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.56 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -150.63 143.1 24.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.036 175.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.23 119.79 57.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.073 0.464 . . . . 0.0 110.4 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 44.0 mttm -94.19 99.46 11.71 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.67 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -80.99 86.81 6.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.319 -0.401 . . . . 0.0 109.93 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 45.5 m-85 -75.91 141.99 42.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.075 0.464 . . . . 0.0 110.885 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -98.69 109.36 22.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.778 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 71' ' ' ILE . 54.3 mt -84.02 92.09 2.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.498 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -76.57 146.68 38.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.73 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.845 ' HE2' ' HA ' ' A' ' 65' ' ' ASP . 21.2 ptmt -110.89 148.54 32.23 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.207 0.527 . . . . 0.0 110.602 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.1 mt -90.13 26.98 1.73 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.666 173.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.845 ' HA ' ' HE2' ' A' ' 63' ' ' LYS . 13.4 t70 63.91 -66.26 0.11 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.879 -174.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 54.9 m -125.04 -11.71 7.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.122 -177.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -79.45 -18.13 74.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.834 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 135.5 -170.43 23.03 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.154 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -120.45 138.41 53.81 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.653 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 38.5 p90 -143.81 130.16 19.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.36 0.6 . . . . 0.0 111.569 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.821 HG12 HG12 ' A' ' 61' ' ' ILE . 69.5 mt -77.97 -42.7 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.138 173.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.5 t -115.45 151.33 34.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.13 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 12.2 p -76.06 21.52 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.951 0.405 . . . . 0.0 112.045 -175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -104.69 -52.66 2.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.244 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.3 m -125.19 112.03 15.96 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.047 0.451 . . . . 0.0 111.714 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.653 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -109.85 150.87 27.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.354 176.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.469 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 88.0 m-85 -128.45 149.69 50.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.2 m -76.96 -12.05 59.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.212 0.529 . . . . 0.0 110.993 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 16.7 m -138.06 136.6 36.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.998 -177.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.558 ' O ' HG22 ' A' ' 84' ' ' VAL . 91.8 mt -69.83 -22.32 63.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.981 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -48.55 76.29 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.86 -34.76 78.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.413 177.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 3.3 tm? -55.2 -62.38 1.71 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.504 178.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -63.32 -41.63 93.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.856 -176.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.3 71.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.787 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -72.22 -43.04 65.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.207 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 5.8 m-85 -75.83 -2.11 28.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.138 0.494 . . . . 0.0 111.468 -176.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.0 t -78.96 -21.17 47.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.352 0.596 . . . . 0.0 109.392 172.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HE3' ' HB3' ' A' ' 89' ' ' LYS . 22.8 mtpp -109.13 -49.5 3.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.979 177.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.608 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 76.0 m-70 -111.65 101.11 9.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.5 177.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.611 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -69.97 -33.97 72.76 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 t70 62.94 -82.79 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.249 175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.17 -42.38 8.75 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.707 -0.557 . . . . 0.0 111.707 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.611 ' HB2' ' HB1' ' A' ' 91' ' ' ALA . 5.3 mp -63.04 143.17 58.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.244 0.545 . . . . 0.0 110.939 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 49.8 t -74.0 -17.81 60.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -140.32 132.71 28.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.314 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.592 ' H ' ' HD2' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -69.19 142.54 54.26 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.929 -179.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -60.87 109.77 1.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.169 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 10.8 m -98.97 -51.49 3.84 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -171.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 28' ' ' THR . 7.7 p30 -145.0 148.95 34.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.0 t -89.24 143.81 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 51.4 t -55.81 126.54 65.54 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.058 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 20.6 Cg_exo -65.95 129.69 22.61 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.713 2.275 . . . . 0.0 111.162 174.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -102.23 -177.74 3.49 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.978 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.5 m 63.37 69.41 0.57 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.452 0.644 . . . . 0.0 110.71 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 53.4 tptt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.291 -0.861 . . . . 0.0 109.395 -178.323 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.902 0.382 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.38 85.3 1.78 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.251 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.6 mm-40 -78.96 101.13 7.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.487 -175.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 28.19 -78.57 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 125.461 1.726 . . . . 0.0 114.342 -170.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.453 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 10.7 p-90 -76.77 -35.56 57.63 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.546 -174.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.456 ' HA ' HG13 ' A' ' 31' ' ' VAL . 88.3 t80 -94.93 99.99 11.92 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.202 -176.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.636 ' HD2' ' HB2' ' A' ' 30' ' ' LEU . 42.2 m-85 -88.81 9.04 26.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.879 0.371 . . . . 0.0 111.923 -177.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.01 -144.71 22.03 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.991 174.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -100.14 68.86 1.47 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.392 0.615 . . . . 0.0 111.636 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.0 pt -90.77 137.38 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.473 172.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 41.4 p -73.35 165.97 24.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.592 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -60.46 -37.8 82.15 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.581 -173.119 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 28.2 tpt180 -66.02 -40.32 90.98 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.528 -178.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.57 -45.84 88.63 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.987 0.422 . . . . 0.0 110.598 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -61.94 -48.88 78.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.814 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -67.93 -33.52 74.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.891 -178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 tpt85 -58.13 -29.14 65.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.018 0.437 . . . . 0.0 110.505 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -88.95 -38.99 14.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.953 177.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.612 HD21 HD22 ' A' ' 30' ' ' LEU . 76.8 mt -74.88 -20.05 59.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -174.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.23 14.46 3.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.604 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 27.0 t30 -62.58 115.07 14.29 Favored Pre-proline 0 C--N 1.33 -0.253 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 170.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.504 ' HA ' HD11 ' A' ' 54' ' ' LEU . 29.0 Cg_exo -62.66 -0.42 1.95 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.402 2.734 . . . . 0.0 114.281 -171.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -112.26 1.63 16.22 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.169 -0.212 . . . . 0.0 111.318 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.604 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 92.2 m-20 -66.74 128.7 93.98 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 120.933 0.397 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 10.0 Cg_exo -70.61 142.44 44.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.845 2.363 . . . . 0.0 111.285 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.437 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 47.8 ttp180 -64.81 110.95 2.58 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 177.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.88 2.61 6.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.688 -173.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 58.7 m -75.28 118.12 17.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.548 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.4 p90 -124.57 161.31 26.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.123 0.487 . . . . 0.0 112.117 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.636 ' HB2' ' HD2' ' A' ' 7' ' ' PHE . 1.8 pt? -161.44 138.88 8.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 0.0 108.979 170.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.495 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.6 p -106.51 125.64 62.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.679 0.752 . . . . 0.0 111.09 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 24.8 ptt85 -116.15 150.01 38.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.317 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -88.31 127.22 35.47 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.1 m -79.9 110.26 15.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.13 0.49 . . . . 0.0 110.985 -178.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -25.06 61.32 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.6 -179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.86 -3.77 58.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.689 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.5 m -155.0 94.75 1.67 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.698 -0.228 . . . . 0.0 110.576 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -84.84 38.75 0.72 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.716 0.769 . . . . 0.0 110.993 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.01 12.91 4.73 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.186 -1.165 . . . . 0.0 110.186 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.567 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -163.0 142.13 8.66 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.936 -0.632 . . . . 0.0 110.382 -175.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 50.8 m-85 -109.15 179.3 4.2 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 173.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.452 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -134.42 109.08 8.52 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.228 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -90.25 87.51 6.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.4 m -80.69 119.96 23.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.625 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.67 139.79 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.035 0.445 . . . . 0.0 110.265 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.7 t -83.49 119.64 24.93 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 121.722 0.772 . . . . 0.0 110.384 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.437 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 12.7 t70 -106.47 145.64 31.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.282 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.539 ' HD1' ' HG ' ' A' ' 54' ' ' LEU . 77.9 t80 -123.32 124.75 43.67 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.644 -173.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -111.89 140.74 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.221 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.508 HD22 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -82.62 -11.08 58.65 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -172.313 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.508 ' N ' HD22 ' A' ' 50' ' ' ASN . . . -113.51 -35.82 5.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.739 0.304 . . . . 0.0 111.136 -179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -87.5 -51.64 5.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.318 0.58 . . . . 0.0 110.32 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 131.83 -150.97 19.66 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -174.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.539 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 5.2 mp -90.54 139.31 30.81 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.969 0.414 . . . . 0.0 110.736 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -125.73 130.37 51.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.2 t -93.25 112.68 26.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 121.23 0.538 . . . . 0.0 111.003 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -93.47 113.11 25.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.597 177.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -92.5 88.67 6.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.254 -176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 84.9 m-85 -75.79 112.79 12.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.7 mtpm? -81.93 122.9 28.35 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.401 -177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 71' ' ' ILE . 58.8 mt -92.07 92.09 3.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.138 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -75.01 146.01 41.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.262 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HB2' ' NZ ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -107.19 156.08 19.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.302 0.572 . . . . 0.0 111.631 -178.088 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.8 mt -95.08 149.87 20.8 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 165.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.68 -61.45 2.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.936 0.398 . . . . 0.0 111.28 -175.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.0 m -117.79 35.23 4.79 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.38 -107.25 2.13 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.02 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -149.86 -170.42 17.24 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.325 -179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.475 ' HB3' HG22 ' A' ' 61' ' ' ILE . 82.2 m-85 -101.82 138.43 38.81 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.65 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 52.4 p90 -143.93 135.31 25.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.214 0.53 . . . . 0.0 110.786 -178.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.646 HG12 HG12 ' A' ' 61' ' ' ILE . 63.8 mt -82.9 -34.32 11.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.495 0.665 . . . . 0.0 109.373 174.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.5 t -126.95 154.77 44.11 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.647 174.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.1 m -77.88 56.01 1.49 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.164 0.507 . . . . 0.0 111.311 -175.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 74' ' ' ARG . 46.9 mtp180 -139.82 -71.6 0.38 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.656 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -105.28 104.81 14.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.207 -175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -111.7 154.58 24.76 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -136.89 137.6 39.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.912 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.8 p -69.62 -12.55 61.73 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.8 p -134.97 144.37 47.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.07 0.462 . . . . 0.0 110.061 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.0 mt -66.81 -21.74 66.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.578 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -59.52 -49.58 77.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.213 176.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -73.69 -26.54 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.628 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.412 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -57.29 -61.7 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.143 177.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.55 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.1 m -66.01 -44.33 92.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.599 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.79 -39.49 58.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.068 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -84.29 -40.85 17.48 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.062 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.642 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.3 m-30 -73.0 -7.87 53.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.894 0.378 . . . . 0.0 111.946 -176.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.524 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.3 m -86.1 2.33 47.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.346 0.593 . . . . 0.0 109.846 172.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -131.66 -38.32 1.16 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.48 -176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.642 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 74.8 m-70 -133.97 111.8 10.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 172.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.578 ' HB2' ' HA ' ' A' ' 97' ' ' ARG . . . -74.47 -35.15 63.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.697 -173.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 47.7 t0 62.19 -82.41 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.891 0.744 . . . . 0.0 111.258 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -86.15 -37.5 9.07 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.837 -176.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.603 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -69.82 147.26 50.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.98 0.419 . . . . 0.0 110.913 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 70.2 m -73.22 -14.36 61.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.003 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -136.55 131.19 33.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.028 -177.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.578 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 0.2 OUTLIER -64.68 133.97 53.27 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 172.731 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.548 HD22 ' CG ' ' A' ' 29' ' ' PHE . 81.1 mt -56.37 107.3 0.36 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.389 -176.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 21.6 m -96.64 -60.86 1.52 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.937 -172.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.432 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.6 p30 -131.89 149.47 52.43 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.2 t -90.19 143.53 11.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 54.0 t -50.71 120.45 13.14 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.63 -174.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 13.0 Cg_exo -71.33 130.77 17.92 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.969 2.446 . . . . 0.0 111.396 173.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 5.7 p -67.7 109.75 3.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.397 0.617 . . . . 0.0 110.892 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.7 m -83.59 60.19 5.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.505 -178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.8 pttp . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.009 179.692 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 121.35 0.595 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.38 -175.8 2.32 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.69 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.55 ' HB2' ' HB3' ' A' ' 6' ' ' TYR . 67.1 mm-40 -59.08 134.85 57.36 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' HG11 ' A' ' 101' ' ' VAL . 34.7 mt-10 -58.8 -27.53 65.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.1 -174.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.629 ' HA ' HG11 ' A' ' 101' ' ' VAL . 6.6 p-90 -104.91 -32.21 8.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.073 -175.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.558 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 58.8 t80 -90.29 111.02 22.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.796 -174.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -106.68 25.42 11.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.537 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 72.57 -150.37 44.85 Favored Glycine 0 C--O 1.226 -0.368 0 N-CA-C 111.529 -0.629 . . . . 0.0 111.529 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.8 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 15.9 pttm -107.87 71.04 0.79 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.469 0.652 . . . . 0.0 110.589 175.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 pt -73.65 149.27 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.168 172.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -77.86 167.1 22.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.231 -176.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -58.48 -44.1 89.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.82 -0.173 . . . . 0.0 110.81 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 15.9 mmm180 -53.46 -45.12 69.41 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 123.355 0.409 . . . . 0.0 110.753 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -66.17 -50.38 64.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.673 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.524 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 18.0 t -60.65 -51.5 69.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.356 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.599 ' HB3' HD23 ' A' ' 20' ' ' LEU . 68.9 mt-10 -77.21 -20.03 55.89 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.633 -174.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 46.4 ttp180 -61.71 -36.07 79.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.43 0.634 . . . . 0.0 109.329 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.5 mt -81.87 -44.14 17.25 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.034 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.582 HD21 HD22 ' A' ' 30' ' ' LEU . 78.4 mt -72.38 -28.77 63.22 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -173.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.3 mm? -82.88 19.67 1.32 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.958 0.408 . . . . 0.0 111.365 178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 43.7 t-20 -99.59 119.69 59.42 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 23.2 Cg_exo -65.02 1.47 1.89 Allowed 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 123.584 2.856 . . . . 0.0 114.521 -172.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -76.95 -16.88 59.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.958 0.409 . . . . 0.0 110.263 175.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -94.42 124.4 55.53 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.279 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.03 171.17 14.41 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 123.078 2.518 . . . . 0.0 112.765 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -58.88 109.66 0.87 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.62 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.43 -2.09 6.57 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.309 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 50.5 m -74.41 111.23 9.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.737 0.303 . . . . 0.0 110.327 176.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 34.5 p90 -127.26 166.39 17.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.99 0.424 . . . . 0.0 111.454 -175.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.582 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -162.32 145.27 11.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 170.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.486 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.8 p -107.87 123.78 63.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.793 0.806 . . . . 0.0 111.107 -176.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 30.4 ptt85 -126.92 138.14 53.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.348 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.8 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 7.7 tp10 -66.55 141.53 57.82 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 173.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.793 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 50.0 m -71.75 127.68 33.34 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.059 0.456 . . . . 0.0 110.023 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.625 ' HG2' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -58.43 -26.84 63.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.732 -175.346 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.625 HG23 ' HG2' ' A' ' 35' ' ' GLU . 17.2 p -118.66 24.21 11.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.818 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.793 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 7.3 m -141.03 137.19 32.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.869 0.366 . . . . 0.0 110.381 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -102.66 94.72 5.78 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.967 0.413 . . . . 0.0 110.705 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.76 50.83 2.06 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.352 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -159.19 99.3 1.48 Allowed 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 177.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.444 ' CE1' ' HE1' ' A' ' 6' ' ' TYR . 85.5 m-85 -89.92 139.41 30.62 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.705 -169.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 91.4 m -95.93 98.4 10.37 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.882 177.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.486 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.0 tm? -73.37 92.99 1.88 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 174.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 13.9 m -88.45 99.02 11.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.132 -174.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.9 p -101.97 125.38 56.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.257 0.551 . . . . 0.0 110.519 178.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.572 ' HB2' ' HB3' ' A' ' 19' ' ' LEU . 46.8 t -82.49 130.28 35.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.819 177.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.487 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 29.7 t70 -113.98 126.99 55.76 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.713 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -96.72 97.39 9.3 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.615 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -101.95 148.56 25.2 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.451 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -82.3 -20.79 36.73 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.246 -173.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -110.95 -46.33 3.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.959 0.409 . . . . 0.0 110.98 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -85.01 -15.34 44.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.201 -177.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 82.21 -156.61 35.91 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.825 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 22' ' ' PRO . 49.7 mt -76.95 106.29 8.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.546 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -119.56 125.38 48.67 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.711 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.14 120.02 37.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.441 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.487 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 55.3 mttm -93.59 103.03 15.23 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -83.37 90.05 7.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.189 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.484 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 71.7 m-85 -76.33 129.99 37.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.59 178.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -93.9 109.29 21.01 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.382 0.611 . . . . 0.0 110.844 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.484 HG12 HG12 ' A' ' 71' ' ' ILE . 68.1 mt -84.67 112.21 21.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.654 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -103.54 164.57 11.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.396 -177.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -118.08 133.7 55.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.082 0.467 . . . . 0.0 111.241 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.508 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 83.4 mt -88.06 136.76 32.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.951 175.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.67 -20.3 65.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.877 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 48.3 m -128.54 42.78 3.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.323 0.582 . . . . 0.0 110.627 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -168.39 -99.07 0.13 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.228 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -174.41 -147.99 6.37 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.621 -178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -88.14 142.5 27.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.713 0.292 . . . . 0.0 110.243 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.508 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 18.3 p90 -149.1 134.02 18.02 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.268 0.556 . . . . 0.0 111.049 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.578 ' HB ' ' HE2' ' A' ' 87' ' ' TYR . 70.3 mt -87.81 -26.71 5.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 169.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.3 t -146.5 152.86 39.67 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.925 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 15.8 m -82.19 56.24 3.13 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.915 0.388 . . . . 0.0 111.652 -174.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -130.4 -54.75 1.1 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.999 0.428 . . . . 0.0 110.786 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.2 m -122.06 106.8 11.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.417 ' HG2' HD12 ' A' ' 64' ' ' LEU . 20.4 mp0 -99.58 146.37 26.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.656 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 82' ' ' GLN . 74.3 m-85 -136.98 135.98 38.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.991 0.424 . . . . 0.0 110.794 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.1 p -78.54 -27.12 45.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.089 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.458 ' HB2' ' HG3' ' A' ' 82' ' ' GLN . 4.3 m -110.47 135.79 50.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.147 -0.478 . . . . 0.0 109.74 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.7 mt -65.74 -26.56 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.13 -178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -57.42 -40.83 79.17 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.23 0.538 . . . . 0.0 110.337 174.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.461 ' HB2' ' HB3' ' A' ' 77' ' ' PHE . 40.0 mt-30 -71.0 -36.56 72.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.034 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.426 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -58.06 -61.06 2.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.711 -178.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -64.23 -42.52 95.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.292 -0.413 . . . . 0.0 112.076 -176.679 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.15 -50.3 71.53 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -72.89 -40.48 65.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 0.0 111.013 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.591 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 4.4 m-30 -75.7 -1.23 23.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.194 0.521 . . . . 0.0 111.331 -178.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.8 t -75.55 -32.73 60.53 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.153 0.501 . . . . 0.0 109.768 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -105.46 -42.2 5.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.615 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.591 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.6 t-80 -101.3 100.75 11.3 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.73 74.32 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.362 0.414 . . . . 0.0 110.645 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.429 ' HB3' ' H ' ' A' ' 93' ' ' GLY . 1.6 t0 63.61 -86.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.568 172.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.429 ' H ' ' HB3' ' A' ' 92' ' ' ASP . . . -103.47 -27.47 6.43 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.249 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.1 mp -70.64 145.52 50.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 110.521 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 40.8 t -68.76 -24.52 64.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.305 176.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -136.09 136.56 40.25 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.433 ' H ' ' CD ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -72.69 145.17 47.38 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.677 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.511 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 79.9 mt -62.94 102.73 0.38 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.403 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.6 m -87.55 -67.08 0.85 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.851 -172.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.0 p-10 -135.94 144.32 45.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.132 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.629 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -90.0 145.06 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 53.8 t -73.47 132.9 80.88 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.243 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -88.12 173.06 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.027 2.484 . . . . 0.0 111.694 173.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 15.0 p -100.87 117.8 35.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.076 0.465 . . . . 0.0 111.038 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.9 t -129.15 32.15 4.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.843 -178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp . . . . . 0 C--O 1.244 0.804 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.824 -177.895 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 121.01 0.434 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' A' ' 6' ' ' TYR . . . -143.35 92.44 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 172.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' ALA . 53.6 mt-10 70.64 -174.78 0.18 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.041 -168.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -72.8 -43.69 62.44 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.558 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 27.1 p-90 -66.25 -43.15 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.532 0.568 . . . . 0.0 112.532 -172.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' A' ' 2' ' ' ALA . 38.7 t80 -85.54 96.6 9.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.008 0.433 . . . . 0.0 110.502 -178.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -76.21 -62.68 1.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.342 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 138.36 -163.41 25.73 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -177.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.625 ' HB3' ' HB2' ' A' ' 33' ' ' GLU . 8.2 pttm -83.25 62.22 6.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 111.622 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 pt -78.03 132.33 32.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 169.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.3 p -74.68 177.56 6.04 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.815 -0.175 . . . . 0.0 111.399 -173.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -58.79 -49.8 76.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.232 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -55.66 -36.01 66.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.361 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.645 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 35.9 mt-10 -78.4 -53.42 7.28 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.887 -177.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.1 p -62.21 -46.75 87.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.914 -176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.76 -48.52 76.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.085 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.7 tpp85 -59.11 -27.67 65.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.407 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 82.6 mt -71.88 -39.93 69.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 0.0 110.777 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.561 HD12 HG13 ' A' ' 56' ' ' VAL . 50.2 mt -87.55 -18.09 30.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.581 -175.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 20' ' ' LEU . 2.2 mm? -77.73 8.01 5.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.124 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.448 ' OD1' ' HB2' ' A' ' 23' ' ' GLU . 21.1 t-20 -91.19 113.0 56.84 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.529 ' HA ' HD11 ' A' ' 54' ' ' LEU . 60.5 Cg_endo -73.57 9.52 1.53 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.07 2.513 . . . . 0.0 113.501 -173.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.448 ' HB2' ' OD1' ' A' ' 21' ' ' ASN . 29.3 mt-10 -93.0 -10.28 36.82 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.498 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 91.3 m-20 -92.12 133.8 29.64 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.636 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 22.5 Cg_exo -65.39 160.89 40.4 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.183 2.589 . . . . 0.0 112.951 -177.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.694 ' HD3' ' HB3' ' A' ' 48' ' ' PHE . 57.3 ttp180 -72.15 120.19 17.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.754 175.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.64 6.21 25.24 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.526 -0.845 . . . . 0.0 111.837 -176.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 87.7 m -73.06 117.21 14.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.544 ' CZ ' HG22 ' A' ' 101' ' ' VAL . 28.2 p90 -121.19 161.5 21.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.992 0.425 . . . . 0.0 111.923 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -166.16 135.02 3.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.127 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.7 p -99.49 125.3 53.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.602 0.715 . . . . 0.0 110.704 -178.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.592 ' CG ' ' HB2' ' A' ' 42' ' ' CYS . 5.4 ptm180 -112.3 148.19 34.72 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.939 -176.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.625 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 46.7 mt-10 -67.32 120.08 13.24 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 170.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.2 t -75.08 74.82 2.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 176.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 57.1 33.53 23.47 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.357 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.525 ' OG1' ' HD3' ' A' ' 9' ' ' LYS . 3.1 m 54.5 38.18 29.23 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.808 -176.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.1 m -79.16 103.85 9.38 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -61.51 124.06 19.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.919 0.39 . . . . 0.0 110.124 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.458 ' O ' ' HD2' ' A' ' 62' ' ' ARG . . . 106.89 -5.49 36.78 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.118 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -143.3 108.15 4.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.178 0.513 . . . . 0.0 111.254 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -118.5 139.66 51.09 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.592 ' HB2' ' CG ' ' A' ' 32' ' ' ARG . 35.7 m -97.63 104.56 16.59 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.052 -176.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.47 97.16 7.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 172.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 t -93.63 134.72 35.64 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.113 -177.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.1 p -133.13 141.36 44.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.517 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 p -78.34 115.23 17.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.251 0.548 . . . . 0.0 111.074 -178.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.674 ' HB2' ' HE2' ' A' ' 57' ' ' LYS . 10.5 t70 -95.37 139.18 32.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.978 176.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.694 ' HB3' ' HD3' ' A' ' 26' ' ' ARG . 94.1 t80 -109.86 130.13 55.56 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.075 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -124.08 143.99 50.13 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -88.98 -8.37 54.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.148 0.499 . . . . 0.0 110.84 -172.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.15 -45.15 3.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.572 177.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -86.6 -37.09 18.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.434 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 114.93 -90.5 0.53 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.779 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.529 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.3 mt -130.19 147.62 51.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.021 0.438 . . . . 0.0 111.331 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -134.68 149.54 50.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.109 174.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.561 HG13 HD12 ' A' ' 19' ' ' LEU . 39.0 t -107.75 114.8 47.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 120.968 0.413 . . . . 0.0 110.471 178.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.674 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 67.0 mttm -95.42 108.18 20.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.356 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -88.7 88.86 7.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.92 0.391 . . . . 0.0 110.696 177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -78.09 92.17 4.36 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -71.34 126.84 30.71 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.62 0.724 . . . . 0.0 110.932 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 71' ' ' ILE . 70.1 mt -96.12 127.61 48.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.909 -176.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 39' ' ' GLY . 24.2 tpt180 -99.31 140.86 32.87 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 28.1 ttpp -87.34 127.56 35.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' H ' ' A' ' 66' ' ' SER . 21.6 tp -75.53 125.93 30.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.556 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -60.8 -29.43 69.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.354 0.597 . . . . 0.0 109.891 175.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.507 ' H ' ' HG ' ' A' ' 64' ' ' LEU . 4.9 m -85.05 -45.42 12.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.998 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.425 ' H ' ' CG ' ' A' ' 64' ' ' LEU . . . -118.77 -109.1 2.37 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.118 -1.039 . . . . 0.0 113.154 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -130.46 -101.1 0.9 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.177 -173.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -133.07 150.4 52.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.645 0.259 . . . . 0.0 110.889 -175.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -161.23 140.2 10.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.237 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.887 HG12 HG12 ' A' ' 61' ' ' ILE . 55.9 mt -85.08 -27.99 6.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.36 0.6 . . . . 0.0 110.071 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 74' ' ' ARG . 4.4 t -151.06 150.86 31.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.86 -178.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.8 m -78.32 58.89 2.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.25 0.548 . . . . 0.0 111.504 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.669 ' HG2' HG23 ' A' ' 72' ' ' THR . 15.8 ptp180 -142.47 -28.71 0.59 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.936 175.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 36.9 m -139.2 124.49 19.12 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.549 177.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -126.23 144.53 50.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.741 -174.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.508 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 75.0 m-85 -130.96 179.53 5.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.744 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.41 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 14.3 m -95.13 -38.74 10.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.572 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 83.4 p -122.89 166.95 14.19 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.999 0.428 . . . . 0.0 110.666 -177.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.626 ' O ' HG22 ' A' ' 84' ' ' VAL . 86.1 mt -77.62 -17.1 58.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.993 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -48.03 64.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.312 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -61.04 -37.75 83.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.788 176.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.651 HD11 HD11 ' A' ' 71' ' ' ILE . 3.5 tm? -54.13 -66.55 0.38 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.089 . . . . 0.0 110.709 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.3 m -61.34 -43.33 96.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -176.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.51 -42.17 77.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.988 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -82.32 -40.09 21.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.162 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.0 m-85 -74.63 -4.62 38.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.112 0.482 . . . . 0.0 111.194 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.3 t -76.91 -26.46 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.544 0.687 . . . . 0.0 109.427 171.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -101.88 -47.63 4.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.796 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 10.6 t-80 -113.14 109.63 19.11 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.795 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.62 88.85 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.339 0.399 . . . . 0.0 110.8 -177.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.422 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 37.6 t70 67.52 -78.22 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.089 0.868 . . . . 0.0 112.5 169.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -106.14 -37.18 2.55 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.933 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.62 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.14 145.81 54.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.3 0.571 . . . . 0.0 110.966 178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.23 -19.25 59.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.079 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -127.81 125.4 39.73 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 97' ' ' ARG . 7.2 ptp180 -69.75 153.12 43.81 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.477 HD22 ' CG ' ' A' ' 29' ' ' PHE . 63.4 mt -74.45 94.82 2.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.01 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.2 p -89.12 -78.2 0.36 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.725 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -111.07 145.25 38.85 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.544 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.8 t -88.37 138.06 19.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.4 t -55.73 124.4 56.87 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.397 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.52 133.35 23.99 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.068 1.846 . . . . 0.0 110.927 175.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.0 t -66.56 150.01 49.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.152 0.501 . . . . 0.0 109.796 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.4 m -104.44 126.28 51.4 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.725 -170.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 65.1 tttp . . . . . 0 C--O 1.253 1.251 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.637 175.164 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 121.249 0.547 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.41 89.37 6.6 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.899 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -68.41 140.28 55.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.486 -179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -47.75 -53.17 16.03 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -170.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.5 p-90 -64.9 -40.9 95.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.489 -176.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -85.48 85.51 7.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.102 0.477 . . . . 0.0 110.218 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 6.9 m-85 -67.75 -13.59 62.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.663 -179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 99.84 -148.03 18.4 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.983 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -95.79 50.52 1.21 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.08 0.467 . . . . 0.0 110.801 -175.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.3 pt -75.02 147.31 8.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.03 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.7 p -73.85 157.32 36.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.074 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -56.9 -35.3 68.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 0.0 109.984 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 30.3 ttp180 -50.58 -57.18 8.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.874 174.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 27.4 mt-10 -68.61 -45.04 73.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.972 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.2 t -53.7 -58.58 6.68 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.708 -175.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.683 ' HB2' HG11 ' A' ' 56' ' ' VAL . 2.2 pt-20 -73.97 -36.02 64.54 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.456 -174.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -56.73 -38.27 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.724 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 94.2 mt -63.65 -39.18 93.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.666 176.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.512 HD12 HG13 ' A' ' 56' ' ' VAL . 30.4 mt -77.25 -15.75 59.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.152 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.564 HD22 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -76.71 -4.42 43.19 Favored 'General case' 0 C--N 1.333 -0.15 0 O-C-N 122.231 -0.293 . . . . 0.0 111.6 175.691 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -73.87 110.66 9.68 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -57.21 -14.52 15.51 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.487 2.791 . . . . 0.0 113.998 -173.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.49 -10.67 59.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 1.2 p30 -98.89 138.49 20.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 178.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 83.2 Cg_endo -88.09 173.15 5.0 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 123.198 2.599 . . . . 0.0 113.566 -176.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.432 ' HD3' ' ND1' ' A' ' 96' ' ' HIS . 26.1 ttm180 -68.5 128.35 36.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.747 176.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 114.96 -5.0 22.36 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.562 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.63 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 33.0 m -73.34 130.36 40.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CG ' HD22 ' A' ' 98' ' ' LEU . 42.1 p90 -141.63 161.54 37.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.795 0.331 . . . . 0.0 111.501 -176.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.7 pt? -159.67 143.9 14.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.551 173.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -111.96 121.08 63.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.458 0.647 . . . . 0.0 110.801 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 32' ' ' ARG . 22.9 ptt85 -108.65 143.16 38.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.928 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -78.5 100.87 7.07 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.63 176.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -80.62 76.6 7.48 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -5.2 6.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.958 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -69.38 -26.57 64.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.283 0.563 . . . . 0.0 109.767 171.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 39.0 m -139.22 92.18 2.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.423 176.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -60.83 120.81 10.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.999 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 107.43 -6.27 36.07 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.196 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -114.49 95.61 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.323 0.582 . . . . 0.0 110.565 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.748 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 80.7 m-85 -87.07 148.97 25.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.904 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 59.3 m -109.39 106.12 15.78 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.665 -178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.709 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.4 tm? -86.82 90.48 8.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 174.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.3 t -81.89 129.73 34.85 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.463 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.9 p -127.25 143.18 41.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 120.932 0.396 . . . . 0.0 110.676 -176.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -83.44 113.82 21.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.114 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.592 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 8.2 t70 -93.92 142.58 27.22 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -126.51 118.1 24.22 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 120.958 0.409 . . . . 0.0 110.54 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -129.2 144.01 51.06 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.868 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -89.45 31.72 0.9 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.947 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -137.26 -49.57 0.61 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.304 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -99.16 -8.32 25.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.157 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.51 -134.92 12.87 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.232 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.1 mp -88.26 131.03 34.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.797 0.332 . . . . 0.0 110.59 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.592 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 30.8 m-80 -119.94 130.65 54.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.683 HG11 ' HB2' ' A' ' 16' ' ' GLU . 84.8 t -102.32 116.43 45.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.294 0.569 . . . . 0.0 111.022 -177.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -109.62 116.99 32.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.331 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -89.07 99.79 12.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.878 178.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB3' HG23 ' A' ' 71' ' ' ILE . 31.3 m-85 -79.49 155.19 28.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.21 0.529 . . . . 0.0 111.424 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 1.9 mtmt -98.25 107.84 20.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.18 -169.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 71' ' ' ILE . 35.7 mt -99.01 75.71 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 173.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.9 ttp85 -98.28 133.64 42.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.462 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 27.8 ttmt -71.96 139.42 48.66 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.888 177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.25 147.92 51.54 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 169.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -45.47 -47.3 14.0 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.639 0.587 . . . . 0.0 111.375 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.0 m -139.86 48.4 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.971 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -134.06 -107.34 0.97 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.354 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -151.24 -170.66 18.43 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.786 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.409 ' CZ ' ' HE2' ' A' ' 63' ' ' LYS . 95.6 m-85 -91.01 141.23 29.06 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.695 -178.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.524 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 53.5 p90 -145.11 143.57 30.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.648 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.913 HG12 HG12 ' A' ' 61' ' ' ILE . 54.4 mt -90.95 -21.82 6.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 122.014 0.911 . . . . 0.0 108.934 172.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.659 HG21 ' HB3' ' A' ' 92' ' ' ASP . 4.2 t -149.29 153.49 37.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.541 -1.209 . . . . 0.0 109.13 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 m -78.37 46.79 0.65 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 111.828 -174.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 18.8 mtp-105 -131.13 -67.03 0.72 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.275 0.56 . . . . 0.0 109.592 178.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.1 m -103.95 148.96 25.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.534 177.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.7 pt20 -159.48 148.69 18.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.599 0.237 . . . . 0.0 110.92 -174.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -137.38 149.97 47.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 111.033 -176.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.8 t -82.69 -15.12 53.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.869 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.6 m -128.32 141.58 51.39 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.7 mt -67.6 -27.51 66.97 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.483 -173.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.1 tm0? -66.82 -46.66 74.45 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.36 -30.68 71.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.654 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -54.03 -68.04 0.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.866 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -61.98 -42.64 95.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.889 -177.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.21 -47.2 72.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.082 -179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -81.0 -33.66 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.421 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 26.5 m-85 -70.85 -7.35 44.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.955 0.407 . . . . 0.0 111.465 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.1 m -79.86 -16.85 54.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.661 171.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -109.4 -27.36 9.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.33 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.45 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 0.1 OUTLIER -131.42 105.23 7.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.751 -176.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.4 ' HB2' ' HB3' ' A' ' 97' ' ' ARG . . . -72.48 -41.18 66.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.792 0.33 . . . . 0.0 110.864 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.659 ' HB3' HG21 ' A' ' 72' ' ' THR . 0.8 OUTLIER 59.89 -87.43 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.797 176.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -95.12 -30.57 8.19 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.112 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.625 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -68.96 141.49 54.94 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.995 0.426 . . . . 0.0 110.148 177.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.1 -17.3 62.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.628 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.432 ' ND1' ' HD3' ' A' ' 26' ' ' ARG . 80.6 m-70 -137.26 130.28 30.65 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 91' ' ' ALA . 16.8 ptp180 -71.65 148.98 45.98 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.312 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.559 HD22 ' CG ' ' A' ' 29' ' ' PHE . 54.0 mt -62.39 120.09 10.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.546 179.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.5 m -111.43 -60.68 1.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.081 0.467 . . . . 0.0 110.933 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.63 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.9 p-10 -133.25 141.63 48.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.686 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.401 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -79.9 149.89 5.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -177.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.5 t -55.15 121.58 37.36 Favored Pre-proline 0 C--N 1.328 -0.349 0 O-C-N 123.645 0.591 . . . . 0.0 110.775 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -83.54 138.12 8.31 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.54 2.16 . . . . 0.0 111.515 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.4 p -68.09 127.34 32.51 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 p -63.62 123.61 19.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.57 -175.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 C--O 1.248 1.01 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.002 -179.739 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.811 0.338 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.02 166.19 29.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.94 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -118.78 123.0 43.73 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -53.92 -34.61 60.07 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -166.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 19.6 p-90 -82.33 -35.86 27.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.491 ' CE2' ' HA2' ' A' ' 8' ' ' GLY . 64.9 t80 -87.22 109.29 19.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.967 0.413 . . . . 0.0 110.721 -177.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.613 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 40.0 m-85 -96.86 19.85 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.224 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.491 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 65.55 -141.53 42.57 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.357 177.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.616 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 58.8 mtmt -107.35 87.82 2.59 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.178 0.513 . . . . 0.0 110.848 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.8 pt -103.19 155.7 5.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.305 176.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 p -84.94 174.77 9.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 12' ' ' ARG . 18.6 mtm180 -59.67 -48.44 81.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.103 -177.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -54.96 -43.13 73.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.015 -178.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -57.08 -52.25 66.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.003 0.43 . . . . 0.0 110.669 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -67.35 -47.98 68.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.143 -176.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.64 -42.08 87.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.57 -175.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -55.72 -41.47 73.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.829 0.347 . . . . 0.0 111.075 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 96.0 mt -73.85 -44.32 55.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.336 -177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD11 ' CD2' ' A' ' 30' ' ' LEU . 79.0 mt -78.4 -26.35 46.43 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -172.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' A' ' 20' ' ' LEU . 4.0 mm? -81.2 3.85 22.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 111.448 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.46 ' C ' ' H ' ' A' ' 23' ' ' GLU . 94.3 m-20 -73.99 138.02 76.1 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.85 30.37 0.29 Allowed 'Trans proline' 0 N--CA 1.472 0.222 0 C-N-CA 122.878 2.386 . . . . 0.0 112.291 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 21' ' ' ASN . 33.5 mt-10 -121.37 7.47 10.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.72 -178.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 48.7 m-80 -107.54 115.06 59.94 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.569 -178.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 52.1 Cg_endo -69.04 145.8 62.52 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.462 2.108 . . . . 0.0 110.444 170.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.692 ' HG3' ' HA ' ' A' ' 47' ' ' ASP . 55.2 ttp180 -60.71 114.67 3.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.25 6.15 7.64 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.35 -172.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.792 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 94.2 m -84.27 112.47 20.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.75 0.31 . . . . 0.0 110.316 175.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 33.5 p90 -117.09 158.28 24.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.055 0.455 . . . . 0.0 112.114 -171.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.613 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.8 pt? -154.02 138.05 16.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 170.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.6 p -108.61 118.26 55.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.446 0.641 . . . . 0.0 110.869 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ptt-85 -111.13 149.39 30.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.825 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 44.1 tt0 -92.43 130.5 38.09 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -107.51 98.54 8.14 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -72.21 -1.99 17.15 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.378 -173.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.8 p -64.92 -19.48 65.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.601 0.715 . . . . 0.0 109.756 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.79 159.91 22.25 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.082 176.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -80.17 71.9 6.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.124 0.488 . . . . 0.0 110.811 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.37 32.23 12.32 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.843 176.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.67 141.17 30.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.92 0.391 . . . . 0.0 110.18 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.683 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.0 m-85 -117.3 165.4 13.51 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.54 -175.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.0 m -127.66 108.58 10.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.135 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.597 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.5 tm? -89.95 90.57 8.22 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.0 m -89.11 123.29 33.25 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.25 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.473 ' CG1' ' HB2' ' A' ' 57' ' ' LYS . 14.3 p -112.22 130.31 66.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.229 177.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 28' ' ' THR . 46.8 t -68.03 121.69 16.64 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 174.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.692 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 16.5 t70 -122.15 154.5 37.33 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.741 -170.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -135.87 95.8 3.3 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.502 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.51 118.18 11.23 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -75.1 60.53 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.66 0.743 . . . . 0.0 109.765 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.08 -33.73 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.433 -1.258 . . . . 0.0 108.705 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -108.3 -63.7 1.3 Allowed 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.81 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.74 -151.86 21.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.875 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.2 128.38 35.49 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.254 -178.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -151.59 177.53 10.25 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 59.4 t -123.21 119.95 59.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.664 0.269 . . . . 0.0 110.885 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 52.8 mttp -87.24 103.94 15.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 63.0 m-70 -84.75 86.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.277 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.6 ' HB3' ' CG2' ' A' ' 71' ' ' ILE . 45.7 m-85 -72.41 127.77 33.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.178 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.406 ' O ' ' HA ' ' A' ' 71' ' ' ILE . 23.7 pttm -83.39 124.84 31.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.042 0.449 . . . . 0.0 111.403 -176.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 71' ' ' ILE . 57.3 mt -102.25 106.33 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.676 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.439 ' HD2' HH11 ' A' ' 62' ' ' ARG . 11.4 mmt85 -108.81 172.18 6.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.224 -179.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 51.9 mtmt -123.9 157.74 33.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.197 0.522 . . . . 0.0 111.659 -177.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.42 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 60.1 mt -123.51 151.09 43.17 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.724 178.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.33 -64.71 0.74 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 111.145 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 65.8 m -103.1 22.46 13.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.118 0.485 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 64' ' ' LEU . . . -112.97 -97.02 2.28 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.644 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.554 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 158.79 -149.69 19.92 Favored Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.61 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -80.75 126.6 31.51 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.5 ' HB3' ' HG3' ' A' ' 76' ' ' GLN . 30.3 p90 -140.48 141.15 35.41 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.249 0.547 . . . . 0.0 110.271 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.81 HG12 HG12 ' A' ' 61' ' ' ILE . 23.9 mt -101.84 -6.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 122.31 1.053 . . . . 0.0 108.546 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.938 HG21 ' HA3' ' A' ' 93' ' ' GLY . 2.5 t -169.5 160.01 8.86 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.649 -173.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.2 p -74.12 0.38 14.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.757 0.313 . . . . 0.0 111.011 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -67.82 -54.73 16.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.443 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m -142.25 141.35 32.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.872 -174.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.5 ' HG3' ' HB3' ' A' ' 70' ' ' TYR . 24.7 mp0 -125.19 138.1 54.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.93 178.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -130.75 140.74 50.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 0.0 111.191 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.7 p -82.22 -8.63 59.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.332 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 24.7 m -131.23 132.73 44.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.032 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.561 ' O ' HG22 ' A' ' 84' ' ' VAL . 53.4 mt -64.65 -30.32 71.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.871 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -57.72 -46.15 84.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.022 0.439 . . . . 0.0 110.329 175.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.582 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 7.9 mm-40 -77.0 -21.25 54.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.988 -178.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.496 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -62.59 -59.69 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.509 174.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.93 -42.03 88.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.945 -178.215 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.0 -22.09 62.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -91.73 -48.88 6.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.739 0.304 . . . . 0.0 110.591 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.722 ' HD2' ' HG ' ' A' ' 94' ' ' LEU . 7.0 m-85 -73.13 -5.47 39.32 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.789 -176.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.9 p -78.67 -33.0 47.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.261 0.553 . . . . 0.0 110.244 173.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -95.8 -51.65 4.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.141 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.408 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 4.7 t-80 -120.89 107.27 12.49 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.323 177.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -62.58 -37.5 86.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.479 -176.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 65.41 -72.27 0.07 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.193 172.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.938 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -104.01 -22.68 8.63 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.722 ' HG ' ' HD2' ' A' ' 87' ' ' TYR . 15.4 mt -79.42 155.5 28.32 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 35.4 t -82.39 -29.18 30.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.34 0.59 . . . . 0.0 109.937 177.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -127.34 125.62 41.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.36 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.1 ppt_? -72.41 137.72 46.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.016 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.592 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 59.6 mt -61.42 100.63 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.791 -174.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -97.73 -53.38 3.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.697 -173.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.792 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.6 t30 -127.08 136.07 51.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.965 -175.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.7 t -87.01 148.31 4.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.862 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.2 t -50.73 125.21 21.25 Favored Pre-proline 0 C--O 1.235 0.313 0 CA-C-O 121.144 0.497 . . . . 0.0 111.659 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -69.73 144.87 55.61 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.021 2.481 . . . . 0.0 111.749 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.4 p -102.65 158.63 16.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.107 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 3.1 p -80.21 59.68 3.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.465 0.65 . . . . 0.0 110.009 175.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt . . . . . 0 C--O 1.25 1.102 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.566 -177.175 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 121.907 0.86 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.49 65.48 0.88 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.676 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -83.26 -163.3 0.72 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.635 -170.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.453 ' O ' HG11 ' A' ' 101' ' ' VAL . 50.1 mt-10 -57.11 -40.77 77.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.045 -178.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.624 ' HA ' HG11 ' A' ' 101' ' ' VAL . 4.6 p-90 -84.19 -41.62 16.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.508 ' HE1' ' HA2' ' A' ' 8' ' ' GLY . 2.6 t80 -85.41 104.36 15.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.665 -174.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -94.68 -2.66 50.82 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.508 ' HA2' ' HE1' ' A' ' 6' ' ' TYR . . . 79.14 -169.31 53.9 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.795 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 51.9 pttt -67.1 98.75 0.61 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.414 0.626 . . . . 0.0 110.982 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.1 pt -125.66 141.58 45.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.486 172.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 18.2 p -73.73 152.37 40.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.258 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -60.01 -34.94 74.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.016 -176.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.631 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 11.5 ptm180 -55.03 -41.88 71.91 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.334 0.396 . . . . 0.0 111.007 -179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.5 ' HG2' ' HG3' ' A' ' 13' ' ' ARG . 4.9 mm-40 -82.17 -47.61 12.3 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.039 0.447 . . . . 0.0 110.191 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 33.3 t -59.17 -49.3 78.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.674 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB2' HG11 ' A' ' 56' ' ' VAL . 3.9 pt-20 -79.9 -31.49 40.21 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.23 -174.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.631 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 24.0 ttm180 -58.13 -36.53 73.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 174.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.793 HD21 ' HB2' ' A' ' 105' ' ' SER . 71.0 mt -60.48 -44.77 95.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.976 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.521 HD12 HG13 ' A' ' 56' ' ' VAL . 44.7 mt -74.79 -22.92 58.48 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.779 -177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.458 HD22 HG23 ' A' ' 56' ' ' VAL . 2.1 mm? -74.03 -7.95 54.33 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.419 175.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.425 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 94.0 m-20 -80.42 119.95 77.89 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HA ' HD11 ' A' ' 54' ' ' LEU . 13.1 Cg_exo -70.35 44.61 0.47 Allowed 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.484 2.789 . . . . 0.0 113.156 -177.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -115.39 -0.46 13.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.948 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -123.09 145.42 45.98 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.152 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -87.62 172.06 5.87 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.954 2.436 . . . . 0.0 112.439 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -64.15 125.73 25.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.927 177.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.54 12.14 21.84 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.327 -0.94 . . . . 0.0 112.126 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.54 ' HB ' ' OG ' ' A' ' 46' ' ' SER . 32.6 m -81.75 116.31 21.39 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 173.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.469 ' CG ' HD22 ' A' ' 98' ' ' LEU . 38.2 p90 -121.9 168.61 11.68 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.769 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -162.71 127.96 3.25 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 171.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.499 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -91.34 109.61 21.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.023 0.916 . . . . 0.0 110.088 177.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.482 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 18.7 ptt180 -109.49 153.98 23.3 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.404 -1.271 . . . . 0.0 109.587 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.61 152.48 24.8 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.748 ' HB2' ' HB ' ' A' ' 37' ' ' THR . 3.0 p -59.8 125.66 24.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.89 -176.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.07 -53.27 7.59 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.738 -175.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.9 p -108.88 -11.42 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.219 0.533 . . . . 0.0 110.474 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.748 ' HB ' ' HB2' ' A' ' 34' ' ' SER . 6.0 m -91.61 158.93 16.14 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.514 -0.767 . . . . 0.0 108.958 175.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -118.41 80.28 1.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.896 0.379 . . . . 0.0 111.143 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.11 54.51 0.52 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.389 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -155.84 88.84 1.13 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.158 0.504 . . . . 0.0 109.868 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.615 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 64.6 m-85 -64.0 141.22 58.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.077 -175.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.482 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 48.5 t -109.22 107.08 17.21 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 121.142 0.496 . . . . 0.0 110.576 -177.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -86.93 87.58 7.49 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 173.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t -87.06 132.2 33.88 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.6 p -126.46 140.15 49.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.874 0.368 . . . . 0.0 110.23 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.54 ' OG ' ' HB ' ' A' ' 28' ' ' THR . 97.8 p -88.28 139.54 30.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.144 -178.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -123.87 126.87 47.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.325 0.583 . . . . 0.0 110.28 174.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -106.91 89.19 2.93 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.686 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -91.84 152.14 20.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.287 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -100.16 10.42 41.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.043 -174.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -122.01 -42.28 2.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.023 0.439 . . . . 0.0 110.425 176.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.54 -36.01 10.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.592 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 106.59 -156.77 16.05 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.967 -0.635 . . . . 0.0 111.57 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.438 HD11 ' HA ' ' A' ' 22' ' ' PRO . 20.7 mt -69.9 124.46 24.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.882 0.372 . . . . 0.0 110.965 177.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -136.56 146.41 46.12 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.521 HG13 HD12 ' A' ' 19' ' ' LEU . 86.4 t -109.51 127.83 66.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.29 0.567 . . . . 0.0 111.217 -175.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -107.65 98.9 8.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.085 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -79.15 95.99 5.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.228 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.533 ' CZ ' ' HA ' ' A' ' 94' ' ' LEU . 69.5 m-85 -84.8 148.29 26.4 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -114.31 122.05 45.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.092 0.473 . . . . 0.0 111.562 -173.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.615 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 83.5 mt -89.47 93.89 4.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.309 175.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 ttp85 -96.21 156.29 16.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -74.6 146.13 42.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.419 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.715 ' HA ' ' HE2' ' A' ' 70' ' ' TYR . 1.4 tt -53.79 -60.5 3.23 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.689 0.757 . . . . 0.0 109.884 -179.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.5 t70 174.12 -30.29 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 113.477 -1.692 . . . . 0.0 107.582 -176.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -125.39 -62.33 1.21 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.67 178.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.39 67.5 0.25 Allowed Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.951 -1.119 . . . . 0.0 113.265 -176.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -150.59 140.85 8.22 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.384 -1.087 . . . . 0.0 110.384 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -109.24 133.1 53.47 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.216 0.508 . . . . 0.0 110.098 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.715 ' HE2' ' HA ' ' A' ' 64' ' ' LEU . 53.6 p90 -148.03 149.07 31.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.954 0.407 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.523 HG12 HG12 ' A' ' 61' ' ' ILE . 58.3 mt -95.98 -20.89 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.978 0.894 . . . . 0.0 109.156 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -148.61 147.75 29.33 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.911 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.9 m -76.12 55.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -138.49 -35.54 0.6 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.3 m -126.01 120.41 30.22 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.16 -0.216 . . . . 0.0 110.522 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 19.9 mp0 -114.78 136.74 52.75 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -124.06 153.78 40.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.409 176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.6 m -92.46 -19.4 22.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.091 -176.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 53.2 p -131.16 145.7 52.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.951 0.405 . . . . 0.0 110.503 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.516 ' O ' HG22 ' A' ' 84' ' ' VAL . 95.9 mt -75.89 -21.75 56.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.173 -176.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -63.25 -43.11 98.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.168 175.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -73.24 -27.1 61.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.603 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.432 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -57.98 -62.81 1.55 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.064 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -63.63 -42.62 96.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.168 0.432 . . . . 0.0 112.168 -176.643 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.43 92.8 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.697 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -75.88 -42.19 49.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.876 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.576 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 14.1 m-85 -76.25 0.64 18.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.23 0.538 . . . . 0.0 111.79 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 21.3 t -80.97 -30.28 35.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 170.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -96.06 -40.08 9.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.853 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.576 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 3.5 m-70 -110.18 113.08 25.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.291 177.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.28 82.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.764 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.9 t70 68.23 -70.74 0.12 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.532 -1.213 . . . . 0.0 112.116 168.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -131.02 -29.71 0.6 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.331 -0.462 . . . . 0.0 111.981 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.574 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -60.93 -39.84 90.95 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.84 0.829 . . . . 0.0 112.275 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 42.4 t 83.17 -29.65 0.09 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 112.429 -2.169 . . . . 0.0 110.162 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -97.01 124.68 41.05 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 172.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.78 141.67 44.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.289 -175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CG ' ' A' ' 29' ' ' PHE . 66.8 mt -66.09 94.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.002 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.1 m -91.8 -63.81 1.2 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.357 -172.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.4 p30 -133.24 163.35 29.49 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.624 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.4 t -102.26 145.64 11.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.026 0.441 . . . . 0.0 110.892 -174.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.9 t -57.74 137.29 82.87 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.43 -176.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 4.8 Cg_exo -76.33 176.54 9.93 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.527 2.818 . . . . 0.0 112.004 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 14.2 p -90.69 164.78 14.02 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.216 -178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.793 ' HB2' HD21 ' A' ' 18' ' ' LEU . 27.5 t -88.88 150.36 22.91 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 111.749 -173.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.7 pttt . . . . . 0 C--O 1.252 1.195 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.742 173.897 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.23 96.27 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.973 176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -86.69 -179.33 6.56 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.915 -177.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -56.27 -48.46 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.38 0.61 . . . . 0.0 110.216 178.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.676 ' HA ' HG11 ' A' ' 101' ' ' VAL . 8.4 p-90 -89.55 -44.3 10.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.3 -177.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.463 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 3.2 t80 -82.32 86.36 6.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.404 -175.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.556 ' CE2' ' HB ' ' A' ' 104' ' ' THR . 11.2 m-85 -69.86 -31.5 69.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.26 0.552 . . . . 0.0 110.847 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 97.8 -148.35 18.9 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.355 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -83.76 68.8 10.04 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.73 0.3 . . . . 0.0 111.343 -174.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.7 pt -95.47 150.01 4.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.0 p -82.3 166.38 19.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 -176.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -71.06 -20.71 62.33 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.223 0.535 . . . . 0.0 110.324 -178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -65.18 -44.79 87.34 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.57 -51.97 24.8 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.708 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 t -51.89 -68.42 0.17 Allowed 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.624 -177.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -29.29 66.61 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -61.25 -58.05 9.88 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.524 -0.47 . . . . 0.0 111.195 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 mp -63.96 -36.51 84.2 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.699 HD21 HD22 ' A' ' 30' ' ' LEU . 89.3 mt -70.54 -40.93 73.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.648 -177.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.9 mm? -79.33 57.96 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.324 0.583 . . . . 0.0 111.023 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -121.08 119.25 29.83 Favored Pre-proline 0 C--N 1.321 -0.664 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 172.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 31.8 Cg_exo -60.28 -11.67 17.13 Favored 'Trans proline' 0 N--CA 1.473 0.321 0 C-N-CA 123.283 2.655 . . . . 0.0 113.187 -176.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -79.61 -19.15 49.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.95 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -87.92 130.31 47.06 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.046 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -84.85 166.99 11.39 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.683 2.255 . . . . 0.0 112.58 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.48 ' HD2' ' CE1' ' A' ' 96' ' ' HIS . 53.1 ttp180 -57.1 128.74 38.52 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.447 174.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.66 1.3 30.71 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.902 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 70.9 m -77.66 119.88 21.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 175.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 40.4 p90 -134.45 174.08 10.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.909 0.385 . . . . 0.0 111.74 -173.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.699 HD22 HD21 ' A' ' 19' ' ' LEU . 2.0 pt? -171.13 147.59 2.58 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.036 171.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG11 ' HE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -101.26 118.08 47.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.443 0.64 . . . . 0.0 110.771 179.261 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.429 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 18.1 ptt180 -117.31 155.71 29.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.121 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -99.63 135.83 40.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.002 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.451 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 43.1 t -84.71 121.6 27.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.009 0.433 . . . . 0.0 111.097 -178.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -81.0 -18.18 47.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.48 174.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.59 -28.19 26.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.747 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 61.7 m -135.06 93.24 2.97 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.194 0.521 . . . . 0.0 110.627 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 34' ' ' SER . 14.3 mmmm -71.72 113.23 8.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.851 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 122.62 3.13 9.43 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.49 -175.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -139.97 116.67 10.86 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.013 0.435 . . . . 0.0 109.908 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.794 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 17.4 m-85 -92.66 161.64 14.48 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.655 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.429 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 60.8 m -118.67 101.32 8.02 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.969 0.414 . . . . 0.0 110.71 -178.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.3 tm? -77.56 97.95 5.22 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 5.0 m -92.34 105.63 17.79 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.122 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 p -113.56 136.67 49.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.043 0.449 . . . . 0.0 110.892 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.6 t -86.96 127.15 35.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.481 0.658 . . . . 0.0 110.632 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.454 ' CB ' ' HE2' ' A' ' 57' ' ' LYS . 7.4 t70 -112.34 140.08 47.36 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.791 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.434 ' CB ' ' HB2' ' A' ' 26' ' ' ARG . 78.9 t80 -111.11 114.88 28.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.091 0.472 . . . . 0.0 110.457 -176.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -112.35 153.75 26.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.072 175.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -75.51 -20.23 58.86 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.997 -172.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -112.25 -49.41 2.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -80.35 -17.48 51.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -176.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.71 -146.05 28.11 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.869 -0.682 . . . . 0.0 111.891 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.33 125.12 28.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.89 0.376 . . . . 0.0 110.373 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -131.37 138.11 49.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 77.9 t -98.64 124.23 51.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.165 0.507 . . . . 0.0 110.91 -176.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE2' ' CB ' ' A' ' 47' ' ' ASP . 57.0 mttm -102.88 116.68 33.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.974 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -91.69 94.94 9.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.583 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.493 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 62.3 m-85 -77.14 128.95 35.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.347 178.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -81.84 116.65 21.61 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.965 -176.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.794 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.5 mt -96.44 84.09 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 70' ' ' TYR . 43.9 ttm180 -90.12 139.04 31.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.474 . . . . 0.0 111.328 -172.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . 51.4 tttp -90.13 133.3 34.96 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.352 177.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.2 -81.36 0.13 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 177.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -170.13 -64.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.419 -178.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 34.0 p -120.25 -23.28 6.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.714 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -64.7 -52.47 42.37 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.216 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.16 -147.64 19.32 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.344 177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.612 ' CE2' ' HB2' ' A' ' 63' ' ' LYS . 84.2 m-85 -108.87 141.27 41.17 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.614 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 48.9 p90 -135.53 143.66 45.86 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.289 0.566 . . . . 0.0 111.398 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.528 HG12 HG12 ' A' ' 61' ' ' ILE . 61.3 mt -95.08 -24.78 4.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.146 -0.933 . . . . 0.0 108.914 171.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.3 t -133.6 149.64 51.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.2 m -78.39 59.73 2.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.932 -174.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 74' ' ' ARG . 13.8 ptt180 -169.28 -47.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.817 173.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.3 m -99.93 130.06 46.07 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 9.8 pt20 -149.66 153.9 37.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.749 0.309 . . . . 0.0 111.281 -174.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.47 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 93.2 m-85 -139.0 141.57 38.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.618 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.0 p -80.97 -10.8 59.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.617 0.246 . . . . 0.0 111.658 -174.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.5 m -132.29 138.48 47.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.643 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.11 -31.65 72.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.91 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -59.1 -48.64 80.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.611 179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.415 ' OE1' ' HA ' ' A' ' 82' ' ' GLN . 14.4 mm-40 -65.56 -40.72 93.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.647 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.496 HD13 ' N ' ' A' ' 84' ' ' VAL . 1.3 tm? -51.04 -57.98 7.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.615 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.496 ' N ' HD13 ' A' ' 83' ' ' LEU . 9.2 p -75.64 -42.44 41.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.515 -170.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.22 -39.84 83.96 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.335 178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -76.66 -42.99 39.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.854 -179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.554 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -74.86 -16.66 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -175.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.743 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 79.8 p -69.41 -14.57 62.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.795 173.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -113.2 -59.23 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.354 0.597 . . . . 0.0 109.543 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.696 ' HD2' ' HB2' ' A' ' 92' ' ' ASP . 6.5 t60 -98.84 95.33 7.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.796 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.85 -31.12 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 0.0 111.564 -174.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.696 ' HB2' ' HD2' ' A' ' 90' ' ' HIS . 5.5 t70 53.3 -88.08 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.827 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.51 -43.62 12.11 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.357 -0.449 . . . . 0.0 112.408 -177.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.657 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -67.99 137.17 54.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.888 0.375 . . . . 0.0 110.81 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.72 -19.92 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.522 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.48 ' CE1' ' HD2' ' A' ' 26' ' ' ARG . 94.0 m-70 -120.03 139.51 52.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.455 -179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -74.76 134.21 41.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.669 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.743 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 84.9 mt -62.18 99.67 0.14 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.147 0.499 . . . . 0.0 109.783 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.7 m -84.73 -63.97 1.24 Allowed 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.827 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 28' ' ' THR . 6.3 p30 -137.71 143.42 41.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.809 0.337 . . . . 0.0 110.22 -176.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.676 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.9 t -88.3 132.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 42.4 t -65.4 128.35 93.72 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.743 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.58 147.09 35.39 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.491 2.127 . . . . 0.0 112.043 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.556 ' HB ' ' CE2' ' A' ' 7' ' ' PHE . 5.5 t -91.19 158.61 16.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.076 0.465 . . . . 0.0 110.817 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 49.3 m -135.2 27.67 3.47 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.435 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.545 -0.74 . . . . 0.0 109.072 178.153 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 . . . . . 0 N--CA 1.484 1.233 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.89 74.8 0.36 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.637 0.586 . . . . 0.0 110.719 178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 6' ' ' TYR . 20.9 mt-10 -127.89 -143.99 0.29 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.04 -174.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 30.2 mt-10 74.14 -47.94 0.65 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.829 0.852 . . . . 0.0 110.313 -171.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' HE3' HG11 ' A' ' 31' ' ' VAL . 1.4 p-90 -89.76 -32.99 16.72 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 167.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.739 ' HB3' ' HA ' ' A' ' 3' ' ' GLU . 3.1 t80 -80.09 94.31 5.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.826 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.539 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 35.4 m-85 -85.75 -13.08 49.4 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.922 0.392 . . . . 0.0 111.133 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 84.29 -153.51 29.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.645 176.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.509 ' CG ' ' HB2' ' A' ' 33' ' ' GLU . 30.4 mtmm -82.04 53.88 2.34 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.856 0.36 . . . . 0.0 111.819 -175.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.463 HD13 ' HB3' ' A' ' 7' ' ' PHE . 34.2 pt -77.5 140.89 16.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 173.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -70.14 163.67 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -175.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' ' NH1' ' A' ' 32' ' ' ARG . 13.4 ptp180 -57.29 -32.78 66.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.212 0.529 . . . . 0.0 110.153 176.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -60.84 -49.07 78.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.346 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -67.94 -57.35 6.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.32 -177.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.454 ' HB3' ' CD1' ' A' ' 10' ' ' ILE . 5.4 p -62.17 -52.39 64.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.864 -172.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.43 -29.21 61.4 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -172.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.437 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 17.0 tpt180 -69.09 -29.58 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.95 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.31 -43.21 86.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 46' ' ' SER . 6.3 mp -74.8 -31.5 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.48 ' HA ' HD13 ' A' ' 20' ' ' LEU . 2.9 mm? -78.77 -7.68 58.03 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.098 0.406 . . . . 0.0 112.098 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.48 ' OD1' ' HD2' ' A' ' 22' ' ' PRO . 63.1 t30 -68.78 124.69 90.75 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.48 ' HD2' ' OD1' ' A' ' 21' ' ' ASN . 57.2 Cg_endo -70.46 46.68 0.61 Allowed 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 123.246 2.631 . . . . 0.0 114.553 -172.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -127.54 -4.66 5.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.102 0.477 . . . . 0.0 109.89 173.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -92.93 131.46 33.34 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.085 -176.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -86.31 162.64 9.82 Favored 'Trans proline' 0 C--O 1.239 0.559 0 C-N-CA 122.813 2.342 . . . . 0.0 111.776 172.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.626 ' HB2' ' HB2' ' A' ' 48' ' ' PHE . 3.2 ttm180 -60.96 117.87 6.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.18 -6.29 7.23 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.113 -177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.587 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 28.0 m -74.92 112.82 11.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 176.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.523 ' CG ' HD22 ' A' ' 98' ' ' LEU . 34.5 p90 -125.68 161.34 27.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.987 0.422 . . . . 0.0 111.839 -174.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.539 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 2.2 pt? -159.99 138.2 10.2 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.401 171.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.45 HG13 ' HA ' ' A' ' 6' ' ' TYR . 0.1 OUTLIER -98.97 114.76 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.463 0.649 . . . . 0.0 110.585 178.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 29.9 ptt180 -108.22 149.28 28.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.465 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.591 ' HG2' ' CE2' ' A' ' 41' ' ' TYR . 33.1 mt-10 -87.22 126.13 34.62 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.4 t -74.72 115.9 14.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.179 0.514 . . . . 0.0 110.103 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -69.29 -17.08 63.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.786 178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.1 m -78.85 -34.76 44.79 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.281 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 24.7 m -136.67 113.56 10.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.957 0.408 . . . . 0.0 110.928 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -70.51 121.72 18.33 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.033 0.444 . . . . 0.0 110.638 -178.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.668 ' HA3' ' HD2' ' A' ' 63' ' ' LYS . . . 102.05 -4.86 52.66 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.016 -178.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.42 113.3 26.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.082 0.468 . . . . 0.0 110.169 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.782 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 69.1 m-85 -102.4 141.32 35.41 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.598 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 56.7 m -103.2 103.91 14.0 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.654 ' HB3' ' HB2' ' A' ' 59' ' ' TYR . 2.4 tm? -79.67 86.9 5.23 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 172.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.2 m -84.81 114.78 22.33 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.001 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.92 136.55 50.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.938 0.399 . . . . 0.0 110.244 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.519 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 t -78.16 115.45 17.9 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.591 0.71 . . . . 0.0 109.2 172.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -110.25 136.85 48.8 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.445 -1.252 . . . . 0.0 108.982 -175.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 26' ' ' ARG . 56.6 t80 -82.02 126.38 31.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.985 0.421 . . . . 0.0 110.4 -176.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.437 ' HB2' HD22 ' A' ' 55' ' ' ASN . 14.9 t70 -117.54 146.66 43.42 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.3 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.27 -13.9 56.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.839 -173.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.26 -41.19 3.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.815 0.341 . . . . 0.0 110.792 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -85.91 -24.51 26.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.238 0.542 . . . . 0.0 111.039 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.94 -73.14 1.99 Allowed Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 -175.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.08 132.7 49.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.437 HD22 ' HB2' ' A' ' 49' ' ' ASP . 7.0 p30 -132.4 140.38 48.44 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 60.2 t -92.71 109.29 21.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.25 0.548 . . . . 0.0 110.347 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.435 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 34.9 ttmt -92.26 105.21 17.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.74 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -86.6 107.93 18.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.063 -177.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.654 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 99.1 m-85 -86.11 121.79 29.21 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 172.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -83.49 109.77 17.64 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.615 0.721 . . . . 0.0 111.412 -177.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.782 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 72.0 mt -86.95 99.93 9.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.545 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -95.33 146.99 23.97 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.511 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.668 ' HD2' ' HA3' ' A' ' 39' ' ' GLY . 0.1 OUTLIER -92.74 139.08 30.92 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.244 0.545 . . . . 0.0 109.914 177.623 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.442 HD11 ' NE2' ' A' ' 76' ' ' GLN . 13.9 mt -84.17 159.5 21.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.768 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -74.85 74.3 2.12 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.842 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 16.8 m 81.82 26.93 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.893 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.11 -38.87 1.46 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.877 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 145.39 -139.1 8.08 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 121.236 -0.506 . . . . 0.0 111.917 179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -129.08 145.94 51.15 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -150.92 139.33 20.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.173 0.511 . . . . 0.0 111.507 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.538 HD12 ' CE2' ' A' ' 87' ' ' TYR . 33.0 mt -89.04 -30.37 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.913 0.864 . . . . 0.0 108.965 170.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -136.88 144.97 43.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.067 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 3.6 p -66.53 -11.04 50.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.238 -173.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 2.1 ptm180 -85.64 -20.7 29.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.041 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 m -135.69 112.27 10.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 0.0 111.327 -174.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.442 ' NE2' HD11 ' A' ' 64' ' ' LEU . 62.8 mt-30 -115.55 143.93 44.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.668 -176.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.418 ' HZ ' ' CD2' ' A' ' 86' ' ' TYR . 94.7 m-85 -126.97 162.73 25.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.116 177.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 t -86.72 -29.98 22.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.852 -0.158 . . . . 0.0 111.305 -177.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 88.3 p -143.81 167.77 21.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.619 0.247 . . . . 0.0 110.703 -178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 83' ' ' LEU . 2.6 mm? -65.47 -26.4 67.92 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.8 0.333 . . . . 0.0 111.161 177.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.32 -43.16 91.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.429 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -70.1 -31.0 68.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HB3' ' O ' ' A' ' 80' ' ' LEU . 2.2 tm? -55.78 -68.23 0.22 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.699 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -66.96 -41.67 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -173.587 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.98 -27.89 47.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.039 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.418 ' CD2' ' HZ ' ' A' ' 77' ' ' PHE . 85.5 t80 -84.24 -52.39 6.28 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.85 178.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.538 ' CE2' HD12 ' A' ' 71' ' ' ILE . 22.5 m-85 -65.37 -15.91 63.06 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.629 -175.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.643 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 32.9 t -66.23 -32.02 73.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.007 0.432 . . . . 0.0 110.441 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.488 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 73.3 mmtt -113.59 -41.01 3.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.849 -176.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.534 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 13.1 m-70 -120.99 110.17 15.95 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -72.41 -39.25 68.07 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.98 -176.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.0 t70 65.36 -75.52 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.628 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.79 -34.8 4.52 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.593 ' H ' HD12 ' A' ' 94' ' ' LEU . 6.0 mp -58.42 142.09 49.56 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.307 0.575 . . . . 0.0 111.238 176.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 20.7 m -74.45 -24.99 59.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.875 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -137.38 147.95 45.87 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.664 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 89' ' ' LYS . 40.3 mtm180 -84.71 135.77 34.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.037 -177.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 81.7 mt -55.8 110.35 0.71 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.905 0.384 . . . . 0.0 110.537 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 8.5 m -94.92 -63.25 1.19 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.386 -174.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -134.74 146.93 49.87 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.404 HG11 ' HA ' ' A' ' 5' ' ' TRP . 1.5 t -83.37 153.39 3.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.014 -178.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 42.3 t -59.28 136.52 88.56 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.668 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 21.7 Cg_exo -65.68 146.11 83.2 Favored 'Trans proline' 0 C--N 1.347 0.447 0 C-N-CA 123.012 2.474 . . . . 0.0 111.553 175.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 p -89.73 164.05 14.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.667 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 63.0 m 60.98 98.41 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.252 0.621 . . . . 0.0 112.278 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttm . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.33 -0.843 . . . . 0.0 109.999 177.64 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.671 0.272 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.34 62.73 0.55 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -91.58 -175.42 4.19 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.751 -172.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -57.27 -52.67 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.04 0.448 . . . . 0.0 110.434 174.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -71.61 -35.97 70.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.946 -177.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.437 ' HA ' HG13 ' A' ' 31' ' ' VAL . 39.3 t80 -89.41 101.06 13.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.889 0.376 . . . . 0.0 110.793 -176.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.476 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 15.5 m-85 -84.37 -33.62 23.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.369 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.457 ' O ' ' HA ' ' A' ' 32' ' ' ARG . . . 124.83 -166.8 17.36 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.321 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.829 ' HB3' ' HB3' ' A' ' 33' ' ' GLU . 14.1 pttp -89.5 59.28 4.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.877 0.846 . . . . 0.0 111.229 -178.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.1 pt -76.42 149.21 6.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.671 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 47.2 p -82.35 167.75 18.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -177.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -61.84 -38.55 88.62 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.621 -177.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -41.29 68.6 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.232 0.539 . . . . 0.0 110.694 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -78.49 -47.59 17.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.491 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.5 t -61.35 -48.43 81.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.477 -176.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.62 -32.37 69.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.021 -176.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -60.05 -30.57 69.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.95 -40.39 28.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.095 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 30' ' ' LEU . 74.5 mt -81.96 -23.11 36.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 20' ' ' LEU . 3.8 mm? -85.22 42.53 0.95 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.338 0.589 . . . . 0.0 111.261 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -104.62 128.78 26.19 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 169.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.665 ' HA ' HD11 ' A' ' 54' ' ' LEU . 11.9 Cg_endo -55.23 -22.15 31.43 Favored 'Trans proline' 0 N--CA 1.473 0.306 0 C-N-CA 123.495 2.797 . . . . 0.0 114.549 -170.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -98.74 23.75 8.39 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.649 -0.421 . . . . 0.0 111.852 -177.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 14.6 m-80 -78.17 115.46 51.03 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 120.853 0.359 . . . . 0.0 110.045 173.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 24' ' ' ASN . 21.5 Cg_exo -65.35 154.32 74.16 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.907 2.405 . . . . 0.0 111.956 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -66.16 109.1 2.49 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.484 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.91 22.55 5.62 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.544 -178.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.566 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 61.5 m -83.73 124.38 30.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 175.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.473 ' CG ' HD22 ' A' ' 98' ' ' LEU . 29.5 p90 -133.29 161.62 34.0 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.92 138.23 9.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.788 170.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.471 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.1 p -103.47 118.91 51.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.666 0.746 . . . . 0.0 110.855 -179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 19.0 ptt85 -112.67 148.81 33.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.443 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.829 ' HB3' ' HB3' ' A' ' 9' ' ' LYS . 35.0 tt0 -83.93 134.99 34.64 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 37' ' ' THR . 38.0 m -73.75 130.06 39.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.434 0.635 . . . . 0.0 111.565 -174.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -79.36 -18.7 51.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.488 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.2 p -119.89 9.22 11.23 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 34' ' ' SER . 78.9 m -153.79 124.63 7.25 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.758 0.313 . . . . 0.0 110.653 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -103.64 138.87 39.7 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.789 0.328 . . . . 0.0 110.131 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 96.31 9.38 56.88 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -175.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -150.44 120.75 7.32 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.938 0.399 . . . . 0.0 110.392 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 57.0 m-85 -101.3 165.01 11.5 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.454 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 32.4 t -117.47 111.64 19.56 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.744 -179.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.471 HD23 ' HB ' ' A' ' 31' ' ' VAL . 2.3 tm? -90.71 87.03 6.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.4 m -78.28 122.09 25.27 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.869 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 p -118.67 138.43 49.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.96 0.41 . . . . 0.0 110.331 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.0 t -94.19 128.96 40.93 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.604 0.716 . . . . 0.0 110.063 179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -112.16 133.23 54.42 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.519 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -105.97 112.52 25.61 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.457 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -118.59 147.74 43.4 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.469 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -79.58 -13.36 59.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.719 -174.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -119.21 -44.0 2.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 111.246 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -81.4 -20.59 40.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.064 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 85.94 -133.11 11.55 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.98 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.665 HD11 ' HA ' ' A' ' 22' ' ' PRO . 95.0 mt -96.84 109.65 22.31 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.146 0.498 . . . . 0.0 110.284 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -105.87 116.52 32.08 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.009 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 82.7 t -91.62 107.8 19.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.151 0.5 . . . . 0.0 109.937 178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -95.31 114.52 26.31 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.216 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -89.56 87.11 6.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.537 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.449 ' CE2' ' HG ' ' A' ' 94' ' ' LEU . 76.8 m-85 -76.46 157.38 32.25 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 176.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -123.04 120.6 33.81 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.22 0.533 . . . . 0.0 111.51 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.615 HG12 HG12 ' A' ' 71' ' ' ILE . 52.8 mt -89.8 88.24 2.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.782 176.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -93.71 154.46 17.78 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.504 -174.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 68' ' ' GLY . 21.4 pttp -109.8 142.6 40.83 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.105 0.479 . . . . 0.0 110.214 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.483 ' HG ' ' CE1' ' A' ' 70' ' ' TYR . 45.2 mt -78.97 175.01 10.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.801 177.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -62.06 -46.27 89.89 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.705 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.9 t -153.28 58.71 0.77 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -140.59 -33.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.325 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.839 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 121.73 -158.97 16.41 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.248 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -100.67 147.84 25.54 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.448 0.299 . . . . 0.0 110.389 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.483 ' CE1' ' HG ' ' A' ' 64' ' ' LEU . 44.9 p90 -156.04 143.23 19.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.602 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.705 HG21 HD11 ' A' ' 94' ' ' LEU . 62.0 mt -83.86 -29.78 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.578 0.704 . . . . 0.0 109.134 173.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.459 HG21 ' HA3' ' A' ' 93' ' ' GLY . 11.5 t -146.12 161.06 41.01 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.472 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.8 p -78.07 59.34 2.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.986 0.422 . . . . 0.0 111.304 -177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -132.04 -78.98 0.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.37 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.8 m -100.67 122.42 43.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.335 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -104.17 147.11 27.83 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.262 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.587 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 95.9 m-85 -132.02 142.25 49.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 121.343 0.592 . . . . 0.0 111.391 -178.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 t -72.67 -21.3 61.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.517 -177.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.1 p -141.34 172.66 12.37 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.82 0.343 . . . . 0.0 111.231 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 85.7 mt -79.52 -28.19 41.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.712 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -64.9 -43.7 92.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.43 HE21 ' HD1' ' A' ' 77' ' ' PHE . 26.4 mt-30 -60.76 -36.76 79.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.393 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 71' ' ' ILE . 3.2 tm? -55.75 -67.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.564 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.415 ' H ' HG22 ' A' ' 84' ' ' VAL . 0.2 OUTLIER -62.9 -41.47 92.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -175.434 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.94 -34.92 66.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.79 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.976 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.764 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 34.9 m-85 -70.93 -7.75 48.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.373 -176.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.585 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 25.9 t -71.31 -23.04 61.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.188 0.518 . . . . 0.0 110.08 173.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -116.05 -45.75 2.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.177 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.764 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 24.9 m-70 -111.06 116.67 31.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.049 177.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.58 -24.51 64.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.529 ' HB3' ' CE2' ' A' ' 87' ' ' TYR . 35.3 t70 62.63 -81.8 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.612 0.765 . . . . 0.0 112.072 174.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' HA3' HG21 ' A' ' 72' ' ' THR . . . -101.53 -33.26 4.85 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.743 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.705 HD11 HG21 ' A' ' 71' ' ' ILE . 4.0 mp -71.0 171.05 11.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.052 0.453 . . . . 0.0 110.329 175.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . 0.437 ' HG ' ' CE1' ' A' ' 96' ' ' HIS . 5.5 p -114.3 12.74 17.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.455 0.645 . . . . 0.0 109.514 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.437 ' CE1' ' HG ' ' A' ' 95' ' ' CYS . 79.2 m80 -128.26 118.15 22.76 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.001 -0.999 . . . . 0.0 109.756 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 97' ' ' ARG . 33.5 mtt180 -75.66 133.6 40.79 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 176.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 64.8 mt -66.49 88.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.4 m -88.49 -57.5 2.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.439 -171.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.5 p-10 -130.64 145.2 51.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.824 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.88 158.4 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.842 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 52.3 t -56.4 133.64 76.48 Favored Pre-proline 0 C--N 1.327 -0.396 0 O-C-N 123.498 0.499 . . . . 0.0 111.292 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.34 154.56 56.17 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.697 2.265 . . . . 0.0 112.019 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.1 p -94.8 165.48 12.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.513 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.3 t -95.77 119.83 34.96 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -177.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.418 ' HB3' ' HE2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.751 -0.642 . . . . 0.0 110.026 -178.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.4 tm0? . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 120.896 0.379 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.27 135.42 14.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.059 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -68.62 146.62 52.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.299 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.04 -50.11 28.96 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 123.62 0.575 . . . . 0.0 112.101 -172.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.491 ' CE3' ' HB2' ' A' ' 6' ' ' TYR . 4.6 p-90 -77.94 -31.23 50.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.358 -174.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.491 ' HB2' ' CE3' ' A' ' 5' ' ' TRP . 63.4 t80 -91.11 106.33 18.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.789 0.328 . . . . 0.0 111.082 -174.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 43.8 m-85 -94.55 15.32 18.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.511 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.471 ' HA2' ' CE2' ' A' ' 6' ' ' TYR . . . 81.79 -131.09 10.14 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.552 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.459 ' O ' ' HG2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -122.54 115.73 22.68 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.671 0.748 . . . . 0.0 110.033 176.59 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 14' ' ' GLU . 35.1 pt -131.85 154.08 39.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.045 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.7 p -96.9 179.85 4.81 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.549 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 12' ' ' ARG . 8.2 ptm180 -54.51 -32.04 57.3 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.191 0.307 . . . . 0.0 111.232 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' ARG . 59.9 ttp180 -59.72 -51.79 68.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.902 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.566 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 11.8 mp0 -72.68 -45.81 57.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.934 0.397 . . . . 0.0 110.458 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.9 t -59.73 -66.87 0.45 Allowed 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.959 -176.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.06 -23.1 65.2 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -177.495 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -62.66 -42.44 99.62 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.2 0.524 . . . . 0.0 109.963 178.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.8 mt -80.89 -39.57 26.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.878 -177.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 30' ' ' LEU . 62.4 mt -79.45 -35.22 40.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.267 -172.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 3.9 mm? -83.21 14.18 3.68 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.177 0.513 . . . . 0.0 110.524 177.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -92.82 107.19 22.61 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 172.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -72.63 49.17 1.44 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.327 2.685 . . . . 0.0 114.416 -169.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -119.63 4.72 11.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.345 0.593 . . . . 0.0 109.839 172.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -104.59 144.25 28.33 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.339 -178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -84.61 168.7 11.11 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 123.156 2.571 . . . . 0.0 112.054 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -63.96 129.23 39.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.949 0.404 . . . . 0.0 110.834 177.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.19 3.67 31.24 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.213 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.508 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 85.4 m -72.33 109.15 5.86 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.902 -0.406 . . . . 0.0 109.902 175.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.472 ' CG ' HD22 ' A' ' 98' ' ' LEU . 32.5 p90 -126.83 161.31 28.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 111.621 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 19' ' ' LEU . 2.1 pt? -160.59 143.64 13.26 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.41 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -107.78 122.13 61.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.69 0.757 . . . . 0.0 110.905 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.44 ' HD2' ' O ' ' A' ' 10' ' ' ILE . 16.1 ptt180 -117.19 142.07 47.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.228 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -81.92 121.5 26.57 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.807 ' HB2' HG22 ' A' ' 37' ' ' THR . 4.2 m -77.54 113.15 15.06 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.686 0.279 . . . . 0.0 110.304 -177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -70.54 -3.83 19.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.862 0.363 . . . . 0.0 111.477 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.7 t -95.63 9.19 41.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.139 0.495 . . . . 0.0 110.7 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.96 HG21 ' HB3' ' A' ' 40' ' ' ALA . 11.1 t -150.14 169.78 20.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.734 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -123.67 30.08 6.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.558 0.694 . . . . 0.0 110.736 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.459 ' HA2' ' HE2' ' A' ' 63' ' ' LYS . . . 171.2 44.18 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.801 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.96 ' HB3' HG21 ' A' ' 37' ' ' THR . . . -152.34 101.44 2.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.146 0.498 . . . . 0.0 110.614 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 41.9 m-85 -90.71 149.37 22.08 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.82 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.0 m -108.92 106.48 16.48 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.694 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.475 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.6 tm? -84.41 88.2 7.27 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 171.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m -85.5 108.75 18.07 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.357 -176.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 7.2 p -107.89 124.56 64.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.336 0.589 . . . . 0.0 110.653 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.6 t -79.39 129.81 34.82 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.138 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.34 115.65 13.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.136 -176.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -83.45 83.97 7.69 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 170.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -71.21 110.31 5.78 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.03 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -74.19 73.65 1.77 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.203 0.525 . . . . 0.0 110.552 -172.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -177.82 -36.29 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.938 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -121.93 -34.57 3.34 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.709 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.77 -148.45 16.86 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.648 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 96.2 mt -75.51 114.93 14.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.0 111.67 -177.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -126.13 117.39 23.04 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 91.9 t -88.93 106.2 16.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -84.23 102.26 12.5 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.12 -175.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.403 ' CE1' HH21 ' A' ' 32' ' ' ARG . 15.2 m-70 -80.98 93.89 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.914 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.691 ' HB3' HG23 ' A' ' 71' ' ' ILE . 57.4 m-85 -77.13 124.62 28.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.119 0.485 . . . . 0.0 110.025 177.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.4 mmmm -88.23 110.9 21.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.07 -170.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.718 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 54.4 mt -91.45 94.25 4.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.793 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.2 ttp180 -92.01 157.07 16.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.745 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' ' HA2' ' A' ' 39' ' ' GLY . 43.5 mtmt -97.88 147.23 24.65 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.624 0.726 . . . . 0.0 112.168 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.477 ' HB2' ' H ' ' A' ' 68' ' ' GLY . 87.1 mt -115.84 130.55 56.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.332 -1.303 . . . . 0.0 109.212 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -72.54 -22.6 60.99 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.938 0.399 . . . . 0.0 110.482 -178.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 p -113.89 30.97 6.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.789 178.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -160.41 -94.08 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.325 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.477 ' H ' ' HB2' ' A' ' 64' ' ' LEU . . . 173.52 -134.01 2.77 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.828 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -99.26 137.02 38.36 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.421 ' O ' ' HA ' ' A' ' 61' ' ' ILE . 25.8 p90 -144.11 140.46 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.167 0.508 . . . . 0.0 110.839 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 59.2 mt -87.0 -35.37 8.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.781 174.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.2 t -143.63 159.75 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.452 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.2 m -75.88 57.28 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.507 0.67 . . . . 0.0 110.739 -178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -130.74 -64.45 0.83 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.773 -177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.2 m -134.47 123.01 23.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.698 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.29 144.06 44.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.679 0.276 . . . . 0.0 110.831 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -127.62 147.3 50.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 p -83.35 10.5 8.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.126 0.489 . . . . 0.0 111.125 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLN . 30.0 m -148.65 135.23 19.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.773 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.634 ' O ' HG22 ' A' ' 84' ' ' VAL . 82.9 mt -63.25 -35.2 79.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.647 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -61.73 -46.06 91.26 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.713 0.292 . . . . 0.0 110.819 177.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.405 ' HG2' ' HB2' ' A' ' 79' ' ' SER . 13.9 mm100 -61.34 -38.63 87.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.821 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 71' ' ' ILE . 3.2 tm? -58.42 -64.14 1.03 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.994 179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.9 m -63.51 -45.31 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.61 -33.64 68.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -78.12 -46.3 21.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.832 0.349 . . . . 0.0 110.462 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.613 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-85 -73.11 -7.33 50.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.442 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.601 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 28.0 t -74.67 -15.92 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.281 0.562 . . . . 0.0 109.851 174.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -120.58 -51.42 2.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.626 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 9.0 t-80 -103.4 107.06 17.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.76 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 66.92 -65.48 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.071 0.548 . . . . 0.0 112.458 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -125.6 -30.93 0.86 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.952 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.581 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.3 mp -64.92 148.28 51.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.281 0.562 . . . . 0.0 111.183 178.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 62.2 m -78.4 -6.97 56.77 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.933 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -152.71 144.33 23.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -67.62 145.62 54.67 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.91 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 87.5 mt -64.79 95.79 0.16 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 27.7 m -90.34 -60.5 1.91 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.754 -171.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.8 p-10 -131.66 141.19 49.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -176.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.3 t -80.87 149.95 4.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.445 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.7 t -56.7 117.95 20.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -176.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 2.7 Cg_exo -75.18 147.37 33.17 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.912 2.408 . . . . 0.0 110.712 173.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 10.5 t -159.44 169.46 23.87 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.167 0.508 . . . . 0.0 110.793 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.2 t -166.72 155.16 10.22 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.539 ' NZ ' ' HB2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.133 -177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.753 0.311 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.534 ' O ' ' HB3' ' A' ' 6' ' ' TYR . . . -126.53 108.39 11.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.18 179.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 58.75 -170.0 0.12 Allowed 'General case' 0 C--O 1.235 0.306 0 O-C-N 123.6 0.563 . . . . 0.0 111.821 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -98.89 -54.99 2.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.273 0.558 . . . . 0.0 110.063 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.436 ' HE3' ' CG1' ' A' ' 31' ' ' VAL . 5.3 p-90 -68.6 -28.73 67.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.854 -176.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.534 ' HB3' ' O ' ' A' ' 2' ' ' ALA . 23.9 t80 -80.89 125.93 30.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.199 -178.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 16.9 m-85 -118.62 34.6 5.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.043 0.449 . . . . 0.0 111.9 -178.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.5 -141.52 35.43 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.934 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HG2' ' HB3' ' A' ' 33' ' ' GLU . 33.0 mtmm -117.98 48.34 1.41 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.74 0.305 . . . . 0.0 111.22 -179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.1 pt -67.81 151.32 10.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.56 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 50.3 p -80.62 172.46 13.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.203 -178.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -59.77 -48.22 82.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 110.283 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -55.8 -47.5 77.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.137 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.2 -41.13 97.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.931 0.396 . . . . 0.0 110.826 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 22.7 t -62.95 -48.15 80.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.283 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HB3' HD23 ' A' ' 20' ' ' LEU . 61.3 mt-10 -69.74 -27.91 65.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.357 -178.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -60.74 -30.19 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.224 0.535 . . . . 0.0 110.374 175.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.14 -28.49 18.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.469 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.563 HD21 HD22 ' A' ' 30' ' ' LEU . 83.3 mt -93.83 -34.23 13.24 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 16' ' ' GLU . 4.1 mm? -79.17 49.43 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.481 0.658 . . . . 0.0 111.179 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -125.23 112.81 26.18 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.82 41.76 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.998 2.465 . . . . 0.0 113.326 -175.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -128.45 9.44 6.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.931 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -110.5 149.88 40.87 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.681 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -82.92 157.68 15.62 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 122.81 2.34 . . . . 0.0 112.158 176.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtm-85 -62.94 140.07 58.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 120.898 0.38 . . . . 0.0 110.396 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.97 2.43 59.43 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.39 -0.909 . . . . 0.0 111.667 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.712 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 65.3 m -73.2 110.79 7.76 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.583 ' CG ' HD22 ' A' ' 98' ' ' LEU . 27.0 p90 -127.35 158.07 38.24 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.124 0.487 . . . . 0.0 111.586 -172.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.588 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.6 pt? -152.24 132.86 13.92 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.051 -0.977 . . . . 0.0 108.504 170.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.436 ' CG1' ' HE3' ' A' ' 5' ' ' TRP . 2.6 p -103.1 114.27 42.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.854 0.835 . . . . 0.0 110.964 -177.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' HG3' ' HB2' ' A' ' 42' ' ' CYS . 24.4 ptt85 -109.1 144.16 37.5 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.07 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.685 ' HB3' ' HG2' ' A' ' 9' ' ' LYS . 36.6 tt0 -83.36 138.21 33.62 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.131 -178.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 45.4 t -88.01 138.15 31.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.336 0.589 . . . . 0.0 111.686 -175.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -93.34 -15.85 25.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.102 -0.953 . . . . 0.0 110.307 175.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.3 p -98.96 -5.56 30.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -173.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.447 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 17.6 m -148.69 131.63 16.18 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.714 0.292 . . . . 0.0 110.734 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.98 121.33 26.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.47 -178.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.72 31.23 36.87 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.143 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 61' ' ' ILE . . . -130.45 128.84 42.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.92 0.39 . . . . 0.0 110.241 178.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -119.86 147.67 44.41 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.81 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' HB2' ' HG3' ' A' ' 32' ' ' ARG . 35.4 m -105.15 94.75 5.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.529 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' A' ' 61' ' ' ILE . 1.7 tm? -77.93 88.86 4.1 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 174.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.6 m -87.27 114.84 24.23 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.488 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 p -120.25 141.2 41.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.086 0.469 . . . . 0.0 111.124 -176.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.0 t -84.15 129.36 34.9 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.801 178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 25.5 t0 -123.61 61.12 1.07 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.435 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.71 111.44 3.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.381 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 52' ' ' LYS . 9.9 t70 -114.97 144.12 44.09 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.448 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -75.06 -12.44 60.32 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.927 -170.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -104.27 -44.22 5.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.856 0.36 . . . . 0.0 111.304 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.856 ' HG3' HD21 ' A' ' 55' ' ' ASN . 6.6 ptpp? -101.19 -9.0 21.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.19 0.519 . . . . 0.0 111.575 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 90.49 -148.71 19.73 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.544 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 86.0 mt -80.73 114.6 19.73 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.41 0.284 . . . . 0.0 111.129 -177.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.856 HD21 ' HG3' ' A' ' 52' ' ' LYS . 13.4 m-80 -115.13 124.05 50.52 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.622 HG21 HD22 ' A' ' 20' ' ' LEU . 79.8 t -111.59 114.66 47.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.211 0.529 . . . . 0.0 110.373 177.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mttm -97.81 105.59 17.76 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.106 -176.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -81.61 83.9 6.92 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -67.34 127.07 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.29 0.567 . . . . 0.0 111.864 -176.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -82.04 96.1 7.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.485 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.704 HD11 ' HB2' ' A' ' 43' ' ' LEU . 58.6 mt -74.92 97.72 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 175.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -91.4 137.8 32.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.383 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' PHE . 51.2 pttt -91.83 151.57 20.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.253 0.549 . . . . 0.0 109.983 174.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.43 157.51 20.46 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 168.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -51.32 -44.08 61.86 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.3 m -67.51 -26.84 66.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 123.02 42.74 0.39 Allowed Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.37 178.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -115.61 108.66 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.917 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 63' ' ' LYS . 84.7 m-85 -84.97 130.13 34.68 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -143.12 143.25 31.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.394 0.616 . . . . 0.0 111.306 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.703 HG12 HG12 ' A' ' 61' ' ' ILE . 70.8 mt -92.4 -39.44 11.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.469 HG21 ' HB3' ' A' ' 92' ' ' ASP . 1.8 t -114.78 147.89 39.15 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.813 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.0 p -67.81 -7.24 26.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -174.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 74' ' ' ARG . 63.7 mtt180 -83.74 -57.61 3.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.904 0.383 . . . . 0.0 110.812 178.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 86' ' ' TYR . 1.3 m -101.68 104.82 15.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.812 -171.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -113.96 133.87 55.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.668 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 83' ' ' LEU . 83.8 m-85 -124.49 146.6 48.87 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.2 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.4 t -88.23 -2.39 58.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 45.5 m -144.03 137.35 27.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.054 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.538 ' O ' HG22 ' A' ' 84' ' ' VAL . 92.9 mt -65.38 -23.46 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -56.52 -47.72 78.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.297 0.57 . . . . 0.0 110.204 174.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -73.36 -27.2 61.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.638 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.483 ' HA ' ' CD2' ' A' ' 77' ' ' PHE . 3.4 tm? -59.12 -64.74 0.83 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.262 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.25 -44.31 97.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.755 -176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -51.76 -42.27 62.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.032 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.415 ' CD2' HG21 ' A' ' 75' ' ' THR . 91.2 t80 -78.14 -43.05 29.91 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.641 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.1 m-85 -69.84 -12.34 61.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.665 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.475 ' O ' ' HD2' ' A' ' 97' ' ' ARG . 50.0 m -72.63 -22.36 60.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.274 0.559 . . . . 0.0 110.096 173.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -104.59 -44.47 4.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.643 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.641 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 31.6 m-70 -125.5 114.81 19.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -76.39 -40.71 50.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.69 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.469 ' HB3' HG21 ' A' ' 72' ' ' THR . 12.2 t70 65.42 -76.32 0.04 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.732 177.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.03 -40.42 8.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.209 -0.52 . . . . 0.0 112.156 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.649 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.5 mp -67.4 150.15 49.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.061 0.457 . . . . 0.0 110.47 178.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 32.6 t -72.68 -18.03 61.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.558 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -149.79 139.68 21.89 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.625 ' HA ' ' HB2' ' A' ' 91' ' ' ALA . 32.7 ptt85 -73.58 158.18 35.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.093 0.473 . . . . 0.0 111.515 -176.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.583 HD22 ' CG ' ' A' ' 29' ' ' PHE . 59.6 mt -66.52 101.3 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.062 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.8 m -97.65 -41.5 8.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.636 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.712 ' O ' ' HA ' ' A' ' 28' ' ' THR . 3.0 t30 -141.65 132.74 26.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.026 0.441 . . . . 0.0 110.511 -175.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.4 t -81.06 139.39 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.458 ' HA ' HG23 ' A' ' 28' ' ' THR . 51.0 t -53.65 118.76 15.82 Favored Pre-proline 0 C--N 1.33 -0.251 0 O-C-N 123.507 0.504 . . . . 0.0 111.135 -176.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.73 151.96 46.98 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.469 2.113 . . . . 0.0 111.558 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 t -73.61 144.51 45.94 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.943 0.401 . . . . 0.0 110.07 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.1 t -142.5 121.08 12.51 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.095 -171.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 C--O 1.244 0.797 0 CA-C-O 118.637 -0.697 . . . . 0.0 109.758 174.758 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.1 157.63 11.53 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.917 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -80.15 160.35 25.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -51.43 -28.51 13.18 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.538 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.79 ' HA ' HG11 ' A' ' 101' ' ' VAL . 15.3 p-90 -82.03 -28.72 32.35 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.503 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -99.59 110.15 22.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.118 0.485 . . . . 0.0 110.612 -174.668 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -98.94 -0.9 41.27 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.0 -156.6 23.75 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.193 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.6 pttt -86.47 61.35 6.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.396 0.617 . . . . 0.0 111.547 -177.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.557 HD11 HD13 ' A' ' 30' ' ' LEU . 46.3 pt -74.47 138.0 21.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 174.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.6 p -72.94 159.73 33.23 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 15' ' ' SER . 10.2 ptm180 -67.2 -23.54 65.75 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.883 -174.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 23.2 tpt180 -61.89 -39.0 90.43 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -73.96 -35.42 64.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.791 176.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.523 ' HB3' ' HA ' ' A' ' 12' ' ' ARG . 29.0 t -60.52 -67.21 0.42 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.981 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.437 ' OE2' ' HB2' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -54.48 -38.85 66.9 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.739 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -57.15 -39.46 75.27 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -177.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.0 mt -86.6 -34.89 19.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.6 mt -81.07 -17.96 48.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.215 -174.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.54 14.08 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.591 0.234 . . . . 0.0 111.567 177.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.571 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 21.5 t30 -67.77 120.14 71.45 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -57.35 -20.78 41.35 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.043 2.495 . . . . 0.0 113.302 -176.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -98.47 21.1 11.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.858 0.361 . . . . 0.0 111.472 -178.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.571 ' ND2' ' HB3' ' A' ' 21' ' ' ASN . 94.5 m-20 -89.82 118.21 68.76 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 170.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.91 144.3 64.02 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.152 1.901 . . . . 0.0 111.489 175.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.45 ' HB2' ' HB3' ' A' ' 48' ' ' PHE . 41.0 ttp180 -56.41 110.68 0.81 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.109 177.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.16 -0.6 7.08 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.644 -173.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.502 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 37.1 m -77.36 129.05 35.31 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 28.6 p90 -139.39 171.25 14.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.151 0.5 . . . . 0.0 111.959 -173.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.557 HD13 HD11 ' A' ' 10' ' ' ILE . 3.4 pp -158.17 149.2 20.89 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.513 166.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 6' ' ' TYR . 2.6 p -108.07 120.65 59.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.746 0.784 . . . . 0.0 110.814 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.687 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.8 145.95 37.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.279 -179.324 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -89.63 131.89 35.4 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.319 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.8 t -104.64 107.71 18.79 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -75.66 -3.04 32.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.965 0.412 . . . . 0.0 111.315 -173.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.46 -42.64 87.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.33 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' A' ' 40' ' ' ALA . 29.6 m -121.19 127.55 51.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.356 -177.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -79.12 74.26 5.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.419 0.628 . . . . 0.0 110.366 -177.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.554 ' HA2' ' HE3' ' A' ' 63' ' ' LYS . . . 139.52 27.08 0.25 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.202 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.487 ' HB3' ' HB ' ' A' ' 37' ' ' THR . . . -138.86 97.65 3.37 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.174 0.511 . . . . 0.0 110.457 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.774 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 86.7 m-85 -90.7 169.81 10.67 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 176.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.687 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 42.7 t -128.55 110.56 12.38 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.165 0.507 . . . . 0.0 110.582 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.6 tm? -89.68 93.52 9.5 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 175.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 38.0 m -84.49 105.42 15.29 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.3 p -104.4 135.03 44.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 178.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 47.2 t -75.89 125.59 29.39 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.534 0.683 . . . . 0.0 110.467 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -105.94 133.04 51.29 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.514 -1.221 . . . . 0.0 109.173 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.523 ' HA ' ' O ' ' A' ' 53' ' ' GLY . 55.7 t80 -141.73 114.6 8.57 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.761 0.791 . . . . 0.0 112.679 -171.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.888 ' HB3' ' HA3' ' A' ' 53' ' ' GLY . 0.6 OUTLIER -84.75 142.31 29.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.862 165.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -58.91 -12.73 4.84 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -166.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -129.02 -54.32 1.2 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -117.85 -11.18 10.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -166.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.888 ' HA3' ' HB3' ' A' ' 49' ' ' ASP . . . -102.42 58.26 0.59 Allowed Glycine 0 C--O 1.225 -0.411 0 C-N-CA 119.807 -1.187 . . . . 0.0 115.394 -163.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HG ' ' HD1' ' A' ' 48' ' ' PHE . 12.5 mt -90.47 131.4 36.24 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.932 0.866 . . . . 0.0 110.538 171.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.559 ' N ' HD22 ' A' ' 55' ' ' ASN . 0.1 OUTLIER -175.85 166.89 3.1 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.626 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 42.8 t -102.92 125.24 57.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 120.773 0.321 . . . . 0.0 110.176 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -99.22 101.44 12.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -82.19 104.06 12.24 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.334 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.401 ' HB3' HG23 ' A' ' 71' ' ' ILE . 54.2 m-85 -91.37 136.68 32.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.872 173.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -93.51 127.49 39.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.182 0.515 . . . . 0.0 110.958 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.774 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 56.6 mt -93.5 101.41 12.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.259 177.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.2 142.79 27.34 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.831 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HE3' ' HA2' ' A' ' 39' ' ' GLY . 26.0 ttpp -108.75 128.57 54.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.614 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.8 mt -75.81 150.69 37.65 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.876 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -53.06 -54.7 31.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.053 0.454 . . . . 0.0 111.406 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 47.9 m -129.87 45.69 2.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.208 -178.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 -107.21 0.74 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.202 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -152.83 -151.11 5.59 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.778 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -110.15 141.82 42.51 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.769 ' HB3' ' HB3' ' A' ' 76' ' ' GLN . 46.4 p90 -147.38 137.59 23.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.161 0.505 . . . . 0.0 110.923 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.503 HG12 HG12 ' A' ' 61' ' ' ILE . 75.2 mt -84.65 -52.56 12.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.1 t -103.81 146.8 28.1 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.173 -0.921 . . . . 0.0 108.545 171.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 11.5 t -81.74 47.91 1.14 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.238 0.542 . . . . 0.0 111.02 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 73.3 mtp180 -135.37 -57.73 0.79 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.918 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 31.0 m -105.23 116.79 32.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.769 ' HB3' ' HB3' ' A' ' 70' ' ' TYR . 1.4 pt20 -133.73 148.51 51.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.259 -174.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.52 ' HE2' ' HE1' ' A' ' 87' ' ' TYR . 96.1 m-85 -131.79 143.38 50.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.161 -178.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.5 m -75.56 -5.1 43.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 63.5 m -140.88 144.12 35.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.248 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 84' ' ' VAL . 69.6 mt -68.26 -27.27 66.19 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.112 -176.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -54.28 48.9 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -59.38 -33.33 71.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.309 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' C ' ' A' ' 83' ' ' LEU . 3.4 tm? -58.51 -65.24 0.69 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.47 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.2 m -64.83 -44.92 96.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -175.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.32 -43.65 83.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.033 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -76.26 -36.18 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.416 -177.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.566 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 8.4 m-85 -79.88 0.18 32.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.92 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 50.2 m -67.64 -29.74 69.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.48 0.657 . . . . 0.0 109.47 173.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -115.72 -43.22 3.03 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.984 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.566 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 73.1 m80 -94.97 90.88 6.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.308 -178.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.704 ' HB2' ' HG3' ' A' ' 97' ' ' ARG . . . -66.12 -35.57 80.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.884 0.373 . . . . 0.0 110.195 177.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.86 -83.99 0.02 OUTLIER 'General case' 0 C--O 1.235 0.292 0 CA-C-N 114.788 -1.097 . . . . 0.0 111.908 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -91.24 -42.75 4.84 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.993 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.67 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -60.81 153.02 25.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.056 0.455 . . . . 0.0 110.964 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 25.3 p -88.13 -10.07 51.17 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.161 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -121.65 149.99 42.39 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.661 -178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.704 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -105.84 137.6 43.45 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.093 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 61.8 mt -68.62 87.17 0.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.175 0.512 . . . . 0.0 110.706 -177.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 12.7 m -80.41 -48.58 12.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.548 -173.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.502 ' O ' ' HA ' ' A' ' 28' ' ' THR . 0.1 OUTLIER -155.24 152.71 29.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.791 0.329 . . . . 0.0 110.26 -178.804 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.79 HG11 ' HA ' ' A' ' 5' ' ' TRP . 2.1 t -91.52 140.35 16.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.996 -176.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.1 t -69.94 125.49 92.01 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.275 -176.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.99 159.27 44.95 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.796 2.331 . . . . 0.0 111.683 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p -63.02 -20.65 65.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.913 -175.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 10.6 m 62.14 83.84 0.15 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.26 0.553 . . . . 0.0 110.519 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 92.0 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.337 -0.84 . . . . 0.0 110.395 -175.706 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.91 0.386 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.72 172.06 13.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 175.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.16 118.3 5.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.4 0.619 . . . . 0.0 109.727 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -54.9 -43.98 73.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.613 -168.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -76.56 -38.49 54.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -173.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.409 ' HA ' HG13 ' A' ' 31' ' ' VAL . 37.0 t80 -86.34 107.21 17.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.94 0.4 . . . . 0.0 111.053 -173.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.487 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 27.1 m-85 -97.88 14.41 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.361 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.02 -143.42 28.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.763 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.8 pttt -111.17 51.6 0.77 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.138 0.494 . . . . 0.0 111.26 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 pt -61.73 147.17 11.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.057 175.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.7 p -87.82 -175.96 5.33 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.587 -177.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -39.51 94.82 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.97 0.414 . . . . 0.0 110.7 -175.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -55.07 -48.22 73.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.321 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.66 -55.31 15.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.552 -176.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.9 p -61.36 -56.76 16.74 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -172.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HB3' HD23 ' A' ' 20' ' ' LEU . 1.6 mp0 -66.62 -29.25 69.24 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -176.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -66.46 -25.26 66.64 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.935 -0.478 . . . . 0.0 110.481 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.7 mt -85.52 -38.75 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.97 0.414 . . . . 0.0 110.794 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.42 HD11 HD21 ' A' ' 30' ' ' LEU . 81.7 mt -82.06 -28.67 32.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.162 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 20' ' ' LEU . 4.0 mm? -78.89 52.35 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.997 0.427 . . . . 0.0 111.442 178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 51.3 m-80 -136.33 132.02 18.78 Favored Pre-proline 0 C--N 1.32 -0.713 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 21' ' ' ASN . 15.3 Cg_exo -69.41 7.67 0.85 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.303 2.669 . . . . 0.0 112.4 -179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -94.36 -1.0 54.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.053 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -97.21 129.18 32.73 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.09 178.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.516 ' HD2' ' OG1' ' A' ' 28' ' ' THR . 15.2 Cg_exo -66.24 138.68 52.21 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.279 1.986 . . . . 0.0 111.087 173.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HD3' ' H ' ' A' ' 48' ' ' PHE . 45.7 ttp180 -61.79 101.31 0.19 Allowed 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 176.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.85 -3.12 3.42 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.505 -171.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.553 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 89.1 m -69.77 117.47 11.41 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 122.452 0.301 . . . . 0.0 110.457 175.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 36.5 p90 -123.98 164.68 18.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.067 0.46 . . . . 0.0 111.821 -175.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB2' ' CD1' ' A' ' 7' ' ' PHE . 1.9 pt? -164.22 146.02 8.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.709 173.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.544 ' HB ' HD23 ' A' ' 43' ' ' LEU . 2.7 p -112.94 120.18 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.52 0.676 . . . . 0.0 111.347 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.536 ' HG2' ' HB2' ' A' ' 42' ' ' CYS . 27.4 ptt180 -107.17 150.98 26.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.169 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -92.45 142.59 27.26 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 175.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.2 t -72.36 123.54 23.26 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -76.88 -15.25 59.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.909 -176.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -101.09 -21.78 14.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.906 -176.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 23.8 m -130.23 121.0 25.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.059 0.457 . . . . 0.0 111.479 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -85.25 115.4 23.0 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 1.034 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 115.1 11.74 10.61 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.603 -175.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -140.03 129.16 23.68 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.006 0.431 . . . . 0.0 110.493 179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.777 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 88.4 m-85 -120.25 179.67 4.22 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.536 ' HB2' ' HG2' ' A' ' 32' ' ' ARG . 61.5 m -139.09 100.11 3.94 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.688 0.28 . . . . 0.0 110.332 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 61' ' ' ILE . 2.8 tm? -82.94 95.96 8.15 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 174.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.5 t -93.19 143.09 26.59 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.91 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 8.8 p -136.05 133.01 50.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.155 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -80.14 126.61 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.592 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.4 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 5.5 t70 -128.52 147.59 50.7 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.792 -178.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.453 ' H ' ' HD3' ' A' ' 26' ' ' ARG . 87.8 t80 -133.34 113.66 12.84 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.335 0.588 . . . . 0.0 110.698 178.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.537 ' HB3' ' HD3' ' A' ' 52' ' ' LYS . 11.6 m-20 -105.8 137.99 42.75 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.84 173.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -71.4 -9.13 57.66 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.353 -173.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -115.17 -21.59 9.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.537 ' HD3' ' HB3' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -103.2 -23.8 13.6 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.858 0.361 . . . . 0.0 111.315 -177.106 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.05 23.09 Favored Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 85.7 mt -78.69 114.79 17.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.928 0.394 . . . . 0.0 110.489 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -108.72 120.18 41.73 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.058 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 74.2 t -92.04 107.09 18.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.035 0.445 . . . . 0.0 109.971 175.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -91.51 100.38 13.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.944 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -85.56 88.99 7.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.491 . . . . 0.0 110.471 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.589 ' HB3' HG23 ' A' ' 71' ' ' ILE . 87.7 m-85 -77.79 88.04 4.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.542 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 42' ' ' CYS . 22.2 pttp -62.75 132.26 51.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.231 -178.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.777 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 70.5 mt -98.8 125.9 52.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.499 -176.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -109.27 137.52 47.03 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.333 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 1.034 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 23.1 mtpp -84.71 145.21 28.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.502 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.99 -6.69 48.92 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 168.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.498 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 10.2 t70 73.93 -55.57 0.66 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.649 178.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.0 m -105.94 24.98 11.49 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.949 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -148.62 -107.82 0.46 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.291 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 78' ' ' SER . . . -129.42 -157.04 9.04 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.205 -174.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.2 m-85 -119.38 141.75 48.79 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -146.07 136.05 23.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.507 0.67 . . . . 0.0 111.6 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.756 HG12 HG12 ' A' ' 61' ' ' ILE . 69.9 mt -82.77 -48.3 17.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.13 173.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -118.53 150.78 39.05 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.904 176.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.9 m -81.1 51.53 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -135.96 -77.53 0.43 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.326 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.0 m -94.47 104.47 16.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.209 0.528 . . . . 0.0 110.01 178.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -110.7 150.21 29.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.766 -173.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -129.51 141.55 50.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.977 0.417 . . . . 0.0 110.916 -178.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.521 ' HA ' ' HA3' ' A' ' 68' ' ' GLY . 15.8 m -83.1 20.46 1.23 Allowed 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.686 -176.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.9 t -167.57 161.45 13.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 176.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.548 ' O ' HG22 ' A' ' 84' ' ' VAL . 58.5 mt -83.48 -34.38 25.39 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -171.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -43.62 80.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -57.39 -36.33 71.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.414 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.418 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.3 tm? -61.81 -62.48 1.77 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.65 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -63.61 -43.21 98.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -175.157 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.04 -45.13 79.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.75 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -75.24 -42.61 54.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.776 0.322 . . . . 0.0 110.994 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.628 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 3.8 m-30 -70.16 -4.15 20.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.509 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.7 t -70.63 -29.39 65.76 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.332 0.587 . . . . 0.0 109.725 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -107.11 -48.02 3.56 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.704 177.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.628 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 11.9 m-70 -107.24 102.41 11.72 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.276 -179.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 94' ' ' LEU . . . -68.42 -37.08 79.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.814 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 t70 68.39 -71.63 0.11 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.69 175.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.44 -39.23 3.28 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.127 -0.558 . . . . 0.0 111.86 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.658 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.9 mp -63.04 146.54 53.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.876 0.369 . . . . 0.0 110.68 176.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 69.6 m -80.1 -15.6 56.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.335 177.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -133.42 135.31 44.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.661 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -85.1 152.41 23.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.034 0.445 . . . . 0.0 110.63 -179.179 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 29' ' ' PHE . 56.6 mt -67.56 101.83 1.06 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.959 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 24.2 m -91.58 -62.84 1.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 -175.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' A' ' 28' ' ' THR . 5.2 p-10 -133.67 147.92 51.45 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -177.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.537 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.3 t -91.13 151.75 3.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.251 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 52.4 t -57.97 124.71 70.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.016 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 102' ' ' CYS . 9.2 Cg_endo -89.76 178.14 2.44 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 123.39 2.726 . . . . 0.0 112.277 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.4 p -110.42 132.72 53.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.434 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 45.2 t 64.18 61.07 0.93 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.479 0.487 . . . . 0.0 110.853 -175.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.357 177.846 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 . . . . . 0 N--CA 1.478 0.962 0 CA-C-O 121.47 0.653 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.02 144.92 0.46 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.052 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.499 ' HB2' ' CB ' ' A' ' 6' ' ' TYR . 5.9 mm-40 -69.55 137.46 52.44 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.451 ' O ' HG11 ' A' ' 101' ' ' VAL . 28.5 mm-40 -55.0 -29.69 57.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.504 -172.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.408 ' HE3' HG11 ' A' ' 31' ' ' VAL . 9.0 p-90 -96.14 -33.94 11.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.959 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CB ' ' HB2' ' A' ' 3' ' ' GLU . 9.8 t80 -79.54 93.64 5.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.796 -174.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.448 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 14.9 m-85 -80.74 -21.48 41.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.115 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 89.57 -158.05 27.11 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.596 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.578 ' HG2' ' HB2' ' A' ' 33' ' ' GLU . 66.5 mttm -79.26 55.14 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.6 pt -78.18 153.69 5.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 173.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -83.96 154.14 23.5 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.785 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 13' ' ' ARG . 17.8 ptt85 -56.94 -40.07 75.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -170.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.432 ' N ' ' HG3' ' A' ' 12' ' ' ARG . 22.3 tpp180 -60.54 -35.01 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.63 0.253 . . . . 0.0 110.72 -177.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 46.7 mt-10 -65.56 -40.25 92.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.229 177.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 19' ' ' LEU . 14.6 m -66.58 -47.6 72.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.269 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.24 -40.17 96.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.639 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -57.64 -31.99 66.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.277 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 14' ' ' GLU . 92.0 mt -84.86 -39.66 18.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.397 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 30' ' ' LEU . 60.2 mt -80.77 -27.93 36.58 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -173.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.481 HD12 HD13 ' A' ' 54' ' ' LEU . 3.8 mm? -79.83 50.71 1.21 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.669 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -135.99 139.23 29.75 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -72.49 14.41 0.49 Allowed 'Trans proline' 0 N--CA 1.474 0.38 0 C-N-CA 123.202 2.601 . . . . 0.0 112.843 -177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -97.32 -1.74 43.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.44 ' HA ' ' HD2' ' A' ' 25' ' ' PRO . 41.2 m-80 -110.34 112.76 56.84 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.358 -177.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 24' ' ' ASN . 30.2 Cg_endo -65.36 157.0 60.27 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.53 2.153 . . . . 0.0 111.432 175.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -63.13 99.76 0.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.98 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 138.32 -0.66 2.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.009 -0.615 . . . . 0.0 112.072 -174.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 100' ' ' ASN . 59.7 m -72.38 124.68 25.64 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 98' ' ' LEU . 31.7 p90 -132.15 166.07 22.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.14 0.495 . . . . 0.0 112.127 -173.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.516 HD22 HD21 ' A' ' 19' ' ' LEU . 1.8 pt? -160.3 143.51 13.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.713 170.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.454 ' HB ' ' CD2' ' A' ' 43' ' ' LEU . 3.1 p -107.12 115.44 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.636 0.731 . . . . 0.0 111.171 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HG3' ' HB3' ' A' ' 42' ' ' CYS . 1.6 ptm180 -104.05 157.4 17.14 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.812 177.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.578 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 49.5 mt-10 -96.31 137.68 35.03 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 174.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -82.81 118.11 23.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.604 0.716 . . . . 0.0 109.398 176.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -62.57 -40.18 96.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.996 -178.741 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.2 p -84.98 -65.87 0.96 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.323 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.2 m -77.68 92.09 4.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.439 0.637 . . . . 0.0 110.567 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -82.32 151.98 26.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.756 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.462 ' HA2' ' HD3' ' A' ' 63' ' ' LYS . . . 82.67 14.43 75.78 Favored Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -172.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -149.49 113.83 5.23 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.968 0.413 . . . . 0.0 110.173 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.824 ' HB2' ' HB ' ' A' ' 61' ' ' ILE . 22.9 m-85 -92.62 175.41 6.83 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.543 ' HB3' ' HG3' ' A' ' 32' ' ' ARG . 43.8 t -135.31 102.93 5.32 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.206 -178.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.454 ' CD2' ' HB ' ' A' ' 31' ' ' VAL . 1.4 tm? -85.62 91.34 8.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 173.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 m -86.65 121.23 28.88 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.08 -179.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.9 p -118.72 138.38 49.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.132 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -78.88 120.34 23.36 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.795 0.807 . . . . 0.0 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.628 ' HB3' ' HB2' ' A' ' 55' ' ' ASN . 9.5 t70 -107.26 76.06 1.06 Allowed 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.024 -179.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.575 ' HA ' ' HA ' ' A' ' 54' ' ' LEU . 74.3 t80 -77.54 95.15 4.45 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.54 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -95.92 154.95 16.96 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.211 -177.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -84.15 -16.29 44.08 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.355 -173.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -109.99 -43.74 3.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.75 0.31 . . . . 0.0 111.165 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -82.69 -37.26 25.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.051 0.453 . . . . 0.0 110.818 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 108.61 -162.85 12.82 Favored Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 -176.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.575 ' HA ' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -79.61 104.99 10.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.676 0.751 . . . . 0.0 111.759 179.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.628 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 10.1 m-80 -102.14 157.18 17.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.322 178.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.0 t -112.79 115.56 50.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.143 0.497 . . . . 0.0 110.259 170.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -93.52 109.15 20.76 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.601 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -89.31 98.7 11.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.855 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -92.58 103.45 15.85 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -69.69 125.71 27.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.327 0.584 . . . . 0.0 111.048 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.824 ' HB ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 mt -91.97 93.9 4.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.38 155.18 23.64 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.023 -173.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.462 ' HD3' ' HA2' ' A' ' 39' ' ' GLY . 59.8 mtpt -105.43 146.63 29.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.792 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 65' ' ' ASP . 98.4 mt -78.8 -74.22 0.29 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.206 173.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.421 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 6.2 p-10 173.2 -44.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.543 177.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.7 p -136.86 -29.89 0.9 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.899 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -61.48 -44.76 97.58 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.766 179.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 144.42 -147.36 18.57 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.889 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -109.86 152.16 26.12 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.05 0.54 . . . . 0.0 109.684 -177.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -150.52 135.75 17.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.192 0.52 . . . . 0.0 111.305 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.653 HG12 HG12 ' A' ' 61' ' ' ILE . 66.5 mt -92.0 -24.02 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 122.198 0.999 . . . . 0.0 108.469 171.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 7.4 t -148.71 145.66 27.77 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.348 178.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.3 m -64.97 -21.4 66.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -169.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -86.48 -0.87 56.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 20.9 m -147.04 108.81 4.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 178.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.33 133.47 55.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.197 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -123.02 132.9 54.33 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.774 0.321 . . . . 0.0 110.622 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 m -79.45 3.4 18.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.6 m -150.68 132.63 15.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.57 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.7 mt -66.19 -25.32 66.88 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.682 -177.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -62.7 -46.8 86.45 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -66.67 -32.07 73.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.55 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.601 HD11 HD11 ' A' ' 71' ' ' ILE . 3.4 tm? -57.56 -65.95 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.302 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -62.54 -43.63 98.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.98 66.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.175 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -76.74 -43.56 36.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.729 0.3 . . . . 0.0 111.053 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' A' ' 90' ' ' HIS . 25.4 m-85 -70.73 -9.09 56.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.608 -177.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.646 ' HA ' ' HB2' ' A' ' 98' ' ' LEU . 70.6 m -67.45 -28.39 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.212 0.53 . . . . 0.0 110.013 173.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -104.49 -48.53 3.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.674 ' O ' ' HA ' ' A' ' 87' ' ' TYR . 56.2 m170 -110.27 116.47 31.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.29 178.02 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.47 -38.01 65.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.814 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 61.02 -78.98 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.092 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -89.86 -40.59 5.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.739 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.627 ' H ' HD12 ' A' ' 94' ' ' LEU . 5.0 mp -67.17 149.36 50.59 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.956 0.408 . . . . 0.0 110.081 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 59.1 m -76.67 -17.93 58.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.537 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -133.04 134.02 43.83 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -68.95 151.27 46.75 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' ' 88' ' ' SER . 74.2 mt -67.79 84.62 0.2 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.202 0.525 . . . . 0.0 109.848 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 15.8 m -73.82 -58.76 3.08 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.234 -172.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.469 ' O ' ' HA ' ' A' ' 28' ' ' THR . 4.4 p-10 -139.75 146.84 40.02 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.069 0.461 . . . . 0.0 110.095 -177.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.521 HG22 ' CZ ' ' A' ' 29' ' ' PHE . 2.5 t -89.31 149.4 4.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.8 -179.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 18' ' ' LEU . 53.2 t -65.68 119.13 57.9 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.155 177.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.5 135.69 26.95 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.588 2.192 . . . . 0.0 112.465 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.0 p -81.7 114.17 20.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.762 176.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.0 t -130.86 123.49 29.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.559 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.103 0 O-C-N 123.744 0.653 . . . . 0.0 110.261 -177.364 . . . . . . . . 1 1 . 1 stop_ save_