data_2hjq_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 2hjq _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 ' 2' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 40.4 m-85 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 t -144.14 146.23 32.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.969 0.414 . . . . 0.0 110.604 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.54 145.68 51.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.389 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -134.78 129.62 34.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.915 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.69 HD21 ' H ' ' A' ' 9' ' ' GLY . 2.8 mt -64.09 117.8 7.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -177.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.477 HG23 ' HB ' ' A' ' 42' ' ' ILE . 42.5 pt -108.39 -28.51 2.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.15 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 40' ' ' TYR . 49.1 tptt -88.91 -34.33 16.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.11 -177.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.69 ' H ' HD21 ' A' ' 6' ' ' LEU . . . -105.13 -157.77 23.06 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.672 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 73.3 mmtt -139.9 -41.76 0.43 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.447 HG21 ' HG2' ' A' ' 20' ' ' ARG . 25.4 m -152.34 114.4 4.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.88 172.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.449 ' CB ' HD13 ' A' ' 6' ' ' LEU . 29.6 t80 -136.31 139.14 42.39 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.685 0.278 . . . . 0.0 110.358 -172.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -106.95 112.39 25.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.962 0.411 . . . . 0.0 110.271 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.448 HG13 HD21 ' A' ' 35' ' ' LEU . 78.8 t -102.09 104.34 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 45.2 ttm 65.71 -79.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.742 0.651 . . . . 0.0 110.668 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.38 10.92 2.74 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.1 mm -108.03 139.63 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 m -108.95 113.27 26.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.929 0.395 . . . . 0.0 111.137 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -107.4 148.86 28.56 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.239 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HG2' HG21 ' A' ' 11' ' ' THR . 31.2 mtp85 -133.01 143.29 49.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 175.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.54 ' HB1' ' O ' ' A' ' 9' ' ' GLY . . . -55.28 127.21 28.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.955 0.407 . . . . 0.0 111.317 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.83 -13.28 67.79 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.162 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -103.77 113.49 40.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.703 0.287 . . . . 0.0 110.842 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.3 m -85.53 136.3 33.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -138.05 134.32 34.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -70.39 130.55 42.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 34.0 m -126.74 155.43 75.14 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.881 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.2 Cg_exo -70.88 166.69 28.15 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.855 2.37 . . . . 0.0 111.469 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -56.7 -36.91 70.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -56.33 -51.16 69.27 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.035 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' A' ' 28' ' ' PRO . 83.0 mt -73.77 -30.11 62.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.044 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -59.16 -46.85 87.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.584 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -80.55 -27.2 37.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.33 -41.76 98.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 173.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.463 HD23 ' CE1' ' A' ' 41' ' ' PHE . 79.4 mt -85.33 -8.21 58.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.605 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.441 ' HA ' HD13 ' A' ' 43' ' ' LEU . 15.4 t30 -72.12 -32.2 66.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 172.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -75.98 -39.03 56.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.728 172.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.584 ' HB3' ' HD1' ' A' ' 40' ' ' TYR . 33.1 m-80 -86.44 108.9 19.69 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.548 -175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.18 44.84 1.68 Allowed 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.072 2.514 . . . . 0.0 113.541 -174.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.584 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 63.0 m-85 -102.41 -16.65 16.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 110.951 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 64.4 m-85 -125.35 158.84 33.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.004 0.431 . . . . 0.0 111.61 -169.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.477 ' HB ' HG23 ' A' ' 7' ' ' ILE . 15.8 tt -97.05 131.64 43.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 165.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 36' ' ' ASN . 69.8 mt -108.58 134.41 51.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.398 0.618 . . . . 0.0 111.091 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.7 m . . . . . 0 C--N 1.317 -0.81 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.69 -179.978 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.524 ' HG2' ' HB3' ' A' ' 76' ' ' ASN . 56.6 Cg_endo . . . . . 0 N--CA 1.454 -0.806 0 CA-C-O 121.022 0.343 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.747 HG12 HD22 ' A' ' 77' ' ' LEU . 8.5 tp -169.65 27.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 122.247 1.022 . . . . 0.0 109.438 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -160.54 109.43 1.67 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.016 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -142.07 174.84 10.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.497 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -64.17 129.43 39.94 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.587 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.3 pp20? -60.27 -31.32 70.11 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -62.02 -37.95 86.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.119 174.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -29.6 42.84 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 120.566 -0.453 . . . . 0.0 110.39 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.444 ' HA ' ' HB2' ' A' ' 65' ' ' MET . 92.1 mt -79.9 -20.25 46.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.102 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 30.2 mmtp -68.04 -30.96 70.31 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.278 0.561 . . . . 0.0 109.962 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.49 26.17 13.77 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.621 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 69' ' ' GLU . 44.0 tpp -104.29 135.48 45.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.662 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 5.6 m-20 -71.92 170.03 14.62 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.782 0.801 . . . . 0.0 112.958 -171.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -58.21 8.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.769 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.45 -24.66 65.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.916 0.389 . . . . 0.0 111.126 -175.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.662 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 8.7 mm-40 -65.04 -54.08 35.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.998 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.522 ' O ' HG13 ' A' ' 74' ' ' ILE . 44.0 m-70 -53.66 -40.66 66.08 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 176.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.97 -49.22 62.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.623 -176.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 p -61.08 -35.83 78.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.63 0.252 . . . . 0.0 110.874 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 69' ' ' GLU . 94.0 mt -55.7 -61.6 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.104 0.478 . . . . 0.0 110.91 175.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.612 ' HA ' HD12 ' A' ' 55' ' ' ILE . 5.7 mt -70.93 -21.38 22.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -173.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 57.9 m -67.7 -35.08 78.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.843 0.354 . . . . 0.0 110.237 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 17.9 m-80 -72.13 -28.32 63.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.406 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.747 HD22 HG12 ' A' ' 55' ' ' ILE . 42.0 tp -64.43 -34.86 79.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.349 172.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 19.43 10.5 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.924 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 159.64 20.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -95.23 107.16 30.49 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.852 0.358 . . . . 0.0 110.627 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.491 ' HB3' HD12 ' A' ' 74' ' ' ILE . 83.9 Cg_endo -82.91 12.78 2.83 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.333 . . . . 0.0 112.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.6 p -77.89 -25.74 48.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.24 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.77 -37.54 59.16 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.087 0.47 . . . . 0.0 109.879 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -81.98 108.59 15.6 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -105.29 -29.59 10.2 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -170.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -89.68 153.24 20.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.84 0.353 . . . . 0.0 110.601 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.8 91.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -54.64 -48.79 71.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.94 -50.51 73.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.409 0.623 . . . . 0.0 110.807 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.403 ' O ' HG13 ' A' ' 94' ' ' ILE . 90.3 mtt180 -67.24 -39.94 86.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.016 -174.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.3 mt -70.05 -44.24 78.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.681 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.02 -42.4 99.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 0.0 111.335 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.24 -40.55 96.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 90' ' ' ARG . 79.0 mt -67.51 -34.89 71.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.635 ' O ' HG21 ' A' ' 98' ' ' ILE . 53.3 mt -67.36 -23.7 65.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.567 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -30.18 71.3 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.318 176.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 55' ' ' ILE . 2.7 mp0 -88.27 -25.07 23.01 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.395 -178.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.635 HG21 ' O ' ' A' ' 95' ' ' LEU . 8.3 tp -70.47 -22.18 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 173.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.405 173.767 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 85.1 m -112.74 130.36 56.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.205 0.526 . . . . 0.0 111.314 -174.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -114.21 146.1 40.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.176 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -133.97 129.62 36.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.387 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -67.78 118.94 11.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.664 HG13 ' HG3' ' A' ' 8' ' ' LYS . 38.4 pt -109.25 -25.66 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.591 -176.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.664 ' HG3' HG13 ' A' ' 7' ' ' ILE . 99.2 mttt -122.06 96.79 5.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 0.0 111.115 -177.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.22 -118.52 0.99 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.878 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 2.2 ttmp? -175.61 -58.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.449 HG22 ' HG2' ' A' ' 20' ' ' ARG . 4.0 p -141.26 118.11 11.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.28 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -136.35 133.41 36.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.918 0.389 . . . . 0.0 110.634 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -97.24 110.5 23.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.892 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.83 92.01 3.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 173.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 35.1 mtm 62.78 -86.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.688 -176.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -124.23 12.54 8.02 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.536 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.8 mp -120.46 125.3 73.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.734 0.267 . . . . 0.0 110.478 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.4 m -89.95 109.36 20.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.516 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.434 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 81.0 m-85 -92.83 131.2 38.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.995 176.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HG2' HG22 ' A' ' 11' ' ' THR . 80.7 mtt180 -114.79 143.72 44.63 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.22 115.03 2.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.184 178.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.16 -9.49 59.58 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.837 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.9 t -100.72 115.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.881 0.372 . . . . 0.0 110.969 -178.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m -84.95 136.32 33.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.308 176.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.407 ' C ' HG22 ' A' ' 3' ' ' THR . 97.4 mt-30 -141.08 128.21 20.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.208 -177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.5 m -72.72 127.13 31.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.821 0.343 . . . . 0.0 110.273 178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 m -118.68 163.43 25.81 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.685 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.503 ' HD2' HD13 ' A' ' 31' ' ' LEU . 16.7 Cg_exo -69.09 155.76 67.16 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.445 2.096 . . . . 0.0 110.576 169.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -63.94 -24.24 67.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.565 0.221 . . . . 0.0 111.275 -175.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -55.21 -41.45 72.04 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.12 0.486 . . . . 0.0 110.275 171.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.503 HD13 ' HD2' ' A' ' 28' ' ' PRO . 65.9 mt -84.32 -21.93 30.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.84 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.19 -47.38 80.02 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.95 -36.64 75.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.506 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.86 -39.88 95.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.842 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.47 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.7 mt -85.15 -12.08 53.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 178.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -68.26 -33.54 74.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -73.96 -15.1 61.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.953 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -122.44 86.43 48.47 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -71.91 13.59 0.48 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.367 2.711 . . . . 0.0 114.611 -168.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 15.5 p90 -90.93 14.83 12.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.467 0.651 . . . . 0.0 110.515 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.47 ' CE1' HD22 ' A' ' 35' ' ' LEU . 88.8 m-85 -118.26 148.4 42.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.702 169.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.451 ' HB ' HG23 ' A' ' 7' ' ' ILE . 16.5 tt -97.45 129.88 46.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -107.34 114.63 28.79 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.234 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.6 m . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.64 -176.215 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.635 ' O ' HG21 ' A' ' 73' ' ' ILE . 94.8 Cg_endo . . . . . 0 C--O 1.225 -0.156 0 N-CA-C 113.071 0.373 . . . . 0.0 113.071 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tp -145.06 24.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 122.395 1.093 . . . . 0.0 108.084 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -144.66 94.42 2.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.876 -173.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.504 ' HB2' HD11 ' A' ' 62' ' ' LEU . 77.3 m-85 -141.51 160.6 39.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.235 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.468 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 9.4 m -65.45 126.52 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.005 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -64.61 -26.91 68.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.222 0.534 . . . . 0.0 109.642 177.845 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.438 ' H ' HG21 ' A' ' 58' ' ' THR . 9.2 m -68.72 -30.05 68.6 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.609 175.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 13.3 mm-40 -82.1 -44.21 16.82 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.948 0.404 . . . . 0.0 110.341 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.504 HD11 ' HB2' ' A' ' 57' ' ' TYR . 88.1 mt -69.03 -12.69 61.91 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.549 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.7 OUTLIER -67.78 -53.61 25.82 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.472 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.67 57.96 1.89 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.734 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.4 ' HG3' ' HA ' ' A' ' 62' ' ' LEU . 12.0 mmt -120.0 -169.49 1.79 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.583 0.706 . . . . 0.0 111.42 -177.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.5 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 39.0 t30 -100.14 -166.35 1.32 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.829 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.5 ' H ' ' CG ' ' A' ' 66' ' ' ASN . 1.4 ttpm? -100.6 -36.98 8.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.767 0.317 . . . . 0.0 110.561 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.496 ' HA ' ' OE1' ' A' ' 71' ' ' GLU . . . -62.78 -36.45 83.14 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.484 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -74.7 -39.39 61.98 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.032 -176.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.511 ' HA ' HD12 ' A' ' 73' ' ' ILE . 64.6 m80 -56.1 -42.78 77.33 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 120.621 0.248 . . . . 0.0 110.814 172.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 42.0 mt-10 -60.72 -46.72 89.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.229 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.445 ' O ' ' HB2' ' A' ' 76' ' ' ASN . 22.8 m -67.77 -31.42 71.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.126 178.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.635 HG21 ' O ' ' A' ' 54' ' ' PRO . 30.7 mt -58.44 -57.6 10.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.527 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -86.64 -11.83 11.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.97 -171.735 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 p -81.03 -34.57 32.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 72' ' ' SER . 4.4 t-20 -65.18 -34.58 78.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.608 0.718 . . . . 0.0 109.265 174.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.402 HD23 ' OE1' ' A' ' 97' ' ' GLN . 53.4 tp -63.25 -25.16 68.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.997 175.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.97 11.29 60.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.241 -177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.578 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 1.6 tpm_? -93.0 -35.57 13.2 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 122.9 -0.177 . . . . 0.0 110.832 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.446 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 38.3 t30 70.45 108.96 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.721 0.638 . . . . 0.0 111.055 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.514 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 2.9 Cg_exo -75.16 65.17 6.21 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.953 2.435 . . . . 0.0 112.943 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 t -92.37 -29.21 16.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.389 . . . . 0.0 110.631 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.29 -23.96 32.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.259 0.552 . . . . 0.0 111.131 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -82.44 126.73 32.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.878 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -108.76 -57.82 2.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.563 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -89.7 154.34 20.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.445 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -61.04 -30.82 70.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.648 0.261 . . . . 0.0 110.63 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.58 -54.29 39.51 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.311 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.41 -37.38 70.11 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.308 0.575 . . . . 0.0 110.634 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.443 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.3 mtt-85 -68.25 -45.74 72.38 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.422 -178.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 87' ' ' ALA . 75.4 mt -65.13 -43.67 95.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.621 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.5 80.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.484 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -71.26 -43.42 67.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.209 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 90' ' ' ARG . 91.7 mt -59.45 -43.03 89.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.133 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.495 HD21 HD13 ' A' ' 98' ' ' ILE . 19.1 mt -57.52 -39.04 75.68 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.281 174.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -68.33 -27.58 66.4 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.001 -174.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.497 ' N ' HE21 ' A' ' 97' ' ' GLN . 0.0 OUTLIER -83.37 -19.56 35.87 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.69 178.425 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.495 HD13 HD21 ' A' ' 95' ' ' LEU . 71.0 mt -67.48 -42.06 86.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 170.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.684 174.839 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.508 ' O ' ' HA ' ' A' ' 26' ' ' THR . 76.3 m-85 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.468 HG23 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -104.69 122.27 45.31 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.963 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.65 133.0 56.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.1 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -132.35 133.97 44.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.237 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.57 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 2.8 mt -67.07 125.36 25.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.157 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.641 HG13 ' HG3' ' A' ' 8' ' ' LYS . 32.0 pt -111.64 -15.77 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.109 0.481 . . . . 0.0 110.676 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.641 ' HG3' HG13 ' A' ' 7' ' ' ILE . 67.5 mttm -130.14 134.0 47.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.298 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.96 -124.44 7.52 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.052 175.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -160.99 -59.64 0.05 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.975 0.416 . . . . 0.0 109.937 -171.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.468 HG23 ' HG2' ' A' ' 20' ' ' ARG . 32.6 m -153.08 121.15 6.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.278 -178.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -133.98 126.05 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -98.3 117.98 33.91 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.323 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.686 HG23 HD22 ' A' ' 35' ' ' LEU . 21.4 t -111.91 106.14 20.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.673 -178.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 38.1 tpp 71.38 -1.52 2.73 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.634 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.36 -29.0 3.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.65 -177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.49 HD11 HD12 ' A' ' 31' ' ' LEU . 2.2 mp -82.44 119.93 32.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.0 m -90.01 114.79 26.71 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.078 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -100.08 143.18 30.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.015 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.468 ' HG2' HG23 ' A' ' 11' ' ' THR . 51.6 mtm180 -124.28 142.24 51.42 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.57 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -53.02 113.64 1.17 Allowed 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.426 0.454 . . . . 0.0 111.377 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.58 -13.99 27.5 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.927 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.1 t -104.69 111.31 33.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.964 0.382 . . . . 0.0 111.602 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.468 ' HB3' HG23 ' A' ' 3' ' ' THR . 20.1 m -79.43 137.03 37.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.586 173.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.22 151.83 44.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.508 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 7.6 p -82.97 124.01 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.187 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.497 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 21.3 m -118.37 154.34 52.06 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.927 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -73.56 173.51 13.75 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.773 2.982 . . . . 0.0 113.348 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -49.47 -46.6 48.27 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.667 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.8 mmtm -57.59 -53.8 54.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.095 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.497 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 45.5 mt -67.48 -33.88 76.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -175.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -59.69 -40.96 89.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -79.96 -38.37 32.45 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.417 0.627 . . . . 0.0 110.352 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -39.77 91.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.274 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.686 HD22 HG23 ' A' ' 14' ' ' VAL . 91.6 mt -85.06 -19.12 32.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.714 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -62.06 -32.41 72.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.75 175.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -85.7 3.09 42.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.908 176.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -131.17 94.76 26.59 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.78 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.3 34.48 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.452 2.768 . . . . 0.0 114.621 -169.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.508 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.2 p90 -112.5 8.88 19.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.678 0.751 . . . . 0.0 110.515 172.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.439 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 61.1 m-85 -115.01 148.14 39.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.369 168.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.564 ' HB ' HG23 ' A' ' 7' ' ' ILE . 11.2 tp -96.99 122.77 48.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.254 170.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.9 mt -105.01 114.91 29.39 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.862 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--N 1.314 -0.935 0 CA-C-O 121.212 0.529 . . . . 0.0 110.512 -178.582 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.496 ' O ' HG23 ' A' ' 55' ' ' ILE . 5.4 Cg_exo . . . . . 0 N--CA 1.458 -0.579 0 CA-C-O 120.328 0.053 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.551 HG12 HD23 ' A' ' 77' ' ' LEU . 7.6 tp 54.35 26.15 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.315 1.046 . . . . 0.0 112.163 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -148.54 88.42 1.63 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.146 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -142.64 152.62 42.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.947 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.998 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.4 m -59.29 130.89 49.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.411 175.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.612 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 16.9 pt-20 -61.88 -35.27 77.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.135 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 p -66.57 -30.28 70.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 174.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.998 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 55.9 mm-40 -72.54 -39.55 67.41 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.61 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.528 HD23 ' SD ' ' A' ' 65' ' ' MET . 83.2 mt -74.86 -14.46 60.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.386 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 65.3 mmtt -65.12 -47.28 77.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.821 0.343 . . . . 0.0 110.649 177.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.31 53.94 1.8 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.494 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.528 ' SD ' HD23 ' A' ' 62' ' ' LEU . 95.7 mtp -138.09 162.01 35.29 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -94.87 168.54 10.74 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 20.6 pttp -74.28 -27.35 60.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -169.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.07 -49.48 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.533 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.2 mp0 -57.94 -51.49 69.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.707 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.508 ' O ' HG13 ' A' ' 74' ' ' ILE . 82.0 m-70 -49.89 -40.43 42.84 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.548 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 56.4 mt-10 -65.8 -45.33 82.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.209 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.7 p -74.09 -36.82 64.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.984 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.0 mt -55.09 -59.87 2.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 177.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 70' ' ' HIS . 4.6 mt -76.84 -21.6 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -173.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 71' ' ' GLU . 19.3 t -64.43 -33.58 76.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -72.96 -37.32 67.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.175 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.551 HD23 HG12 ' A' ' 55' ' ' ILE . 45.6 tp -59.06 -38.51 79.56 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.434 175.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.41 -43.72 0.87 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.28 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -101.18 107.19 18.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.776 0.322 . . . . 0.0 110.883 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -69.89 124.4 90.57 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.548 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 42.3 Cg_endo -69.05 73.9 1.01 Allowed 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.609 2.206 . . . . 0.0 114.021 -172.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.4 t -104.04 -20.85 13.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.25 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -87.96 8.73 24.98 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.39 0.614 . . . . 0.0 110.174 175.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -119.08 122.83 42.99 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -87.0 -58.9 2.42 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.779 -173.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -92.24 -179.91 5.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 111.434 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.431 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -74.3 -36.59 63.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.679 -176.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -64.33 -38.03 89.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.262 -176.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -58.51 -39.54 80.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.468 ' O ' HG13 ' A' ' 94' ' ' ILE . 77.1 mtt85 -70.4 -40.42 73.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.756 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 87' ' ' ALA . 79.5 mt -63.37 -41.74 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.269 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.67 96.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.219 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -63.91 -38.42 91.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.325 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.47 HG12 HD13 ' A' ' 55' ' ' ILE . 65.8 mt -65.54 -47.52 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 177.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.489 HD21 HD12 ' A' ' 98' ' ' ILE . 30.4 mt -60.58 -36.37 78.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.953 0.406 . . . . 0.0 111.65 178.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.6 ttpt -63.35 -32.25 73.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.319 -175.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.23 -28.71 47.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 0.0 110.786 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.489 HD12 HD21 ' A' ' 95' ' ' LEU . 63.9 mt -68.23 -40.31 82.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 109.685 175.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.1 t70 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.23 177.637 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.601 0.238 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.8 p -126.22 139.65 53.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.03 136.27 45.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.775 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 5.6 ptpp? -133.25 143.57 49.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.973 0.416 . . . . 0.0 110.775 177.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.683 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -70.76 140.56 51.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.503 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.515 HD13 HG13 ' A' ' 42' ' ' ILE . 43.1 pt -122.82 -43.93 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 67.8 mttm -94.89 94.09 7.83 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.038 0.447 . . . . 0.0 110.462 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.05 -116.04 0.98 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.103 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -179.03 -55.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.9 m -140.57 115.5 9.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.33 176.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -135.87 133.8 38.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.533 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 64.5 t30 -102.35 121.61 42.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.091 -176.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.6 t -108.55 106.64 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.214 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.5 mtt 64.48 -85.84 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.993 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -136.19 9.01 4.12 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 121.251 -0.499 . . . . 0.0 111.887 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.466 HD12 HD12 ' A' ' 31' ' ' LEU . 3.8 mp -118.59 112.76 39.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.6 m -88.56 122.94 32.56 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.039 0.447 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -103.36 143.8 32.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.471 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -120.11 146.04 46.33 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.829 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.683 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.53 115.49 2.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.304 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.65 -16.59 60.23 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.693 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -103.28 110.97 31.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.79 0.328 . . . . 0.0 110.208 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.775 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 20.3 m -82.77 136.52 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.253 0.549 . . . . 0.0 111.877 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -114.54 149.41 36.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.436 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -81.68 119.28 23.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 27.7 m -119.44 152.7 53.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.832 0.349 . . . . 0.0 111.574 -173.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.407 ' HD2' HD11 ' A' ' 31' ' ' LEU . 13.3 Cg_exo -71.51 177.38 6.84 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.134 2.556 . . . . 0.0 112.087 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.0 -39.51 86.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.469 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -59.37 -52.82 63.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.313 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 67.3 mt -68.14 -28.91 67.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.393 -175.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -60.87 -52.9 63.1 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -73.47 -31.36 63.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.342 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -61.41 -50.39 73.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB2' HD23 ' A' ' 43' ' ' LEU . 80.1 mt -81.41 -16.9 50.73 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.841 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -69.49 -29.54 67.21 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.301 0.572 . . . . 0.0 109.67 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.18 -20.85 37.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.568 177.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -94.51 111.35 53.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.433 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.76 29.7 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.262 2.642 . . . . 0.0 114.554 -168.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.465 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.1 p90 -129.21 19.34 5.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.295 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -130.87 136.91 49.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.515 HG13 HD13 ' A' ' 7' ' ' ILE . 4.0 mt -97.8 124.63 50.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.497 HD23 ' HB2' ' A' ' 35' ' ' LEU . 5.5 mp -122.07 131.12 53.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.357 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.317 -0.817 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.451 -179.982 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.629 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 57.2 Cg_endo . . . . . 0 N--CA 1.456 -0.718 0 N-CA-C 113.334 0.475 . . . . 0.0 113.334 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.629 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 10.9 tp 163.15 29.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 122.196 0.998 . . . . 0.0 108.569 177.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.49 ' HA ' HD11 ' A' ' 98' ' ' ILE . 27.3 t30 -158.33 89.48 0.98 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.092 -171.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -139.17 164.94 28.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.783 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -64.74 145.16 56.63 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -58.88 -37.56 76.86 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 174.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.5 m -63.68 -32.84 74.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.25 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -28.59 62.05 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.319 0.58 . . . . 0.0 110.378 177.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.438 ' HB3' HG12 ' A' ' 91' ' ' ILE . 91.4 mt -87.77 -18.82 28.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.259 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -71.06 -43.24 68.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.035 0.445 . . . . 0.0 110.527 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -2.0 90.28 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.922 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.67 ' HG3' ' HG3' ' A' ' 69' ' ' GLU . 49.9 ttm -88.58 131.87 34.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 122.523 0.329 . . . . 0.0 110.34 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.463 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 22.9 m-80 -81.29 175.01 10.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.815 0.34 . . . . 0.0 111.113 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 19.7 ptmt -67.73 -39.28 84.3 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.07 -53.14 61.43 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.455 -174.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.67 ' HG3' ' HG3' ' A' ' 65' ' ' MET . 3.9 pm0 -65.63 -45.88 81.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.89 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.551 ' O ' HG13 ' A' ' 74' ' ' ILE . 17.4 m-70 -44.53 -53.17 7.31 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.02 -42.63 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.46 -176.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.2 m -61.15 -40.69 94.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.848 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 69' ' ' GLU . 79.8 mt -59.21 -58.66 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.527 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.0 mt -70.8 -24.95 25.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.917 0.389 . . . . 0.0 111.13 -173.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.6 m -68.29 -30.18 69.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.785 0.326 . . . . 0.0 110.233 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -75.17 -26.13 58.84 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.384 175.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 74' ' ' ILE . 50.4 tp -63.02 -32.94 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.495 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.51 5.09 30.1 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.868 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.405 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 2.1 tmt_? -128.49 99.2 5.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -70.6 129.52 89.94 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.017 -173.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -83.98 43.89 1.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.037 2.492 . . . . 0.0 112.11 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.8 t -70.41 -30.16 66.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.153 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.19 -18.06 35.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 110.588 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -85.47 118.38 24.96 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -111.62 -19.18 12.6 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.86 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 3.5 m-20 -97.45 145.26 26.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.399 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.01 -33.5 75.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.16 -177.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.42 -39.67 77.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.462 ' CD ' ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp0 -60.65 -33.8 73.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.966 0.413 . . . . 0.0 110.274 175.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 71.6 mtt-85 -67.07 -40.6 87.05 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.438 HG12 ' HB3' ' A' ' 62' ' ' LEU . 97.0 mt -63.15 -45.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.75 93.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.592 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.405 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 33.3 t80 -70.4 -39.43 74.51 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.635 -178.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -67.79 -34.71 69.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.8 mt -64.67 -28.62 69.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.887 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.425 ' O ' ' HD3' ' A' ' 96' ' ' LYS . 5.0 tmtm? -77.21 -28.24 53.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.017 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -6.73 58.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.002 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.49 HD11 ' HA ' ' A' ' 56' ' ' ASN . 48.0 mm -57.02 -40.27 71.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.674 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 C--O 1.232 0.164 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.935 178.569 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.523 ' HB ' ' HB3' ' A' ' 24' ' ' SER . 17.5 p -108.5 131.67 54.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.026 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.79 148.62 28.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.155 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -147.13 132.43 18.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.2 -174.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 6' ' ' LEU . 2.6 mm? -65.31 125.53 25.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.777 175.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.873 HD12 ' HG3' ' A' ' 8' ' ' LYS . 2.7 pp -109.72 -4.63 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.416 0.626 . . . . 0.0 110.36 175.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.873 ' HG3' HD12 ' A' ' 7' ' ' ILE . 61.8 mttm -138.11 127.38 24.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.997 173.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.69 -128.73 8.44 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.311 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -172.68 -48.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.0 m -152.27 128.95 10.81 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -148.92 133.41 17.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.643 0.259 . . . . 0.0 110.741 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.535 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 26.2 t-20 -96.26 123.1 39.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.548 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.5 t -110.54 106.49 20.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.005 177.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 66.35 -74.22 0.06 Allowed 'General case' 0 N--CA 1.466 0.364 0 O-C-N 123.941 0.776 . . . . 0.0 111.363 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.01 -0.36 1.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.683 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.497 HD11 ' N ' ' A' ' 17' ' ' ILE . 3.2 mp -113.0 121.01 64.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.7 m -92.93 105.54 17.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.788 0.328 . . . . 0.0 110.653 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -93.73 161.77 14.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.167 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -133.8 154.65 50.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.321 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.45 130.73 45.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.771 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.99 -5.54 84.98 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.688 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.9 t -111.38 107.66 23.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.745 0.307 . . . . 0.0 110.638 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.523 ' HB3' ' HB ' ' A' ' 3' ' ' THR . 13.0 m -85.53 111.62 20.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.396 178.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -111.93 143.66 42.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.138 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -67.83 128.0 34.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.19 157.42 51.03 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.576 -176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.511 ' HD2' HD13 ' A' ' 31' ' ' LEU . 20.5 Cg_exo -67.31 168.82 16.79 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.27 2.647 . . . . 0.0 112.263 175.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -56.48 -48.9 76.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.804 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -58.45 -47.99 82.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.231 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.511 HD13 ' HD2' ' A' ' 28' ' ' PRO . 42.2 mt -69.29 -27.46 65.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.842 -175.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -57.78 -50.47 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 110.605 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.24 -29.56 38.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.859 0.361 . . . . 0.0 110.558 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.64 -42.15 98.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.5 mt -82.83 -19.78 36.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -70.52 -23.6 62.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.67 0.747 . . . . 0.0 109.316 173.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -92.69 7.85 41.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.474 176.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -108.35 133.21 20.65 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.278 -177.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.12 -11.76 21.27 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.982 2.455 . . . . 0.0 114.832 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.419 ' CB ' ' HB2' ' A' ' 8' ' ' LYS . 6.9 p90 -118.62 23.71 11.32 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.235 -178.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -129.23 119.37 23.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.94 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.61 HD13 HG21 ' A' ' 7' ' ' ILE . 14.4 mt -106.39 125.11 62.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 170.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.12 156.67 19.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--N 1.319 -0.731 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.21 -179.193 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo . . . . . 0 N--CA 1.45 -1.068 0 N-CA-C 114.209 0.811 . . . . 0.0 114.209 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.692 HD11 ' HA ' ' A' ' 94' ' ' ILE . 6.5 tp -178.7 78.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.061 0.934 . . . . 0.0 110.79 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.53 ' OD1' HG13 ' A' ' 98' ' ' ILE . 4.9 t30 -170.15 86.39 0.12 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.801 -176.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.506 ' HB2' HD12 ' A' ' 62' ' ' LEU . 94.4 m-85 -141.39 152.01 43.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.748 0.308 . . . . 0.0 110.925 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.668 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 4.4 m -73.61 143.83 46.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.338 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.535 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 7.0 pt-20 -67.36 -38.71 85.22 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.292 177.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 16.2 m -63.16 -27.58 69.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.291 0.567 . . . . 0.0 109.748 174.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 39.0 tt0 -78.77 -43.52 25.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.226 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.541 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 96.6 mt -79.26 -18.33 52.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.013 -178.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -62.92 -31.42 72.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.787 0.327 . . . . 0.0 110.337 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -102.0 21.84 40.36 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.899 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 25.0 mmt -107.95 146.34 32.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.845 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.756 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 14.4 m120 -71.3 169.64 14.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.52 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 43.3 mtmt -60.41 -50.88 71.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.025 176.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.52 -29.11 67.65 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.659 0.6 . . . . 0.0 111.752 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.756 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 4.9 mm-40 -66.23 -46.38 77.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.705 0.764 . . . . 0.0 109.389 177.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.667 ' HE1' HD13 ' A' ' 91' ' ' ILE . 30.6 m-70 -63.09 -38.94 93.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.103 175.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 42.9 mt-10 -68.29 -34.61 76.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.629 -175.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.8 p -70.42 -34.6 72.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.226 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 69' ' ' GLU . 85.5 mt -58.32 -61.73 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.576 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.517 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -73.6 -13.52 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.4 p -79.49 -32.87 42.53 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.366 -0.534 . . . . 0.0 109.749 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -71.14 -29.45 65.25 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.165 0.507 . . . . 0.0 109.724 173.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.6 tp -73.23 -26.58 61.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.648 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.77 -6.14 67.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.255 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.557 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -73.11 -36.74 66.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.787 0.327 . . . . 0.0 110.199 -179.757 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 79' ' ' ARG . 45.9 m-80 72.38 137.64 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.171 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.517 ' HA ' HD13 ' A' ' 74' ' ' ILE . 6.1 Cg_endo -78.49 -4.18 13.96 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.695 2.263 . . . . 0.0 113.237 -175.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.44 -10.78 57.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.937 0.399 . . . . 0.0 111.464 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -82.72 -15.02 53.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.241 0.544 . . . . 0.0 110.504 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -119.24 146.68 45.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.754 -173.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.757 ' HZ2' ' HB3' ' A' ' 85' ' ' LYS . 5.4 ttpm? -108.76 -65.04 1.17 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 0.0 110.597 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -76.52 157.48 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.914 -176.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.67 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -63.29 -36.78 84.8 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.18 -49.05 67.47 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.281 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.422 ' OE2' ' HB3' ' A' ' 85' ' ' LYS . 40.7 mt-10 -58.29 -37.75 75.65 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.355 0.598 . . . . 0.0 110.493 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 90' ' ' ARG . 4.9 mtm180 -73.45 -34.03 65.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.613 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 87' ' ' ALA . 22.7 mm -63.4 -50.06 80.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 176.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.68 -45.17 81.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.043 -176.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.444 ' CZ ' ' HG3' ' A' ' 79' ' ' ARG . 41.3 t80 -67.15 -47.61 70.52 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.457 -176.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.692 ' HA ' HD11 ' A' ' 55' ' ' ILE . 61.6 mt -67.32 -38.97 81.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.969 0.414 . . . . 0.0 110.211 -178.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.501 HD13 HG23 ' A' ' 98' ' ' ILE . 4.4 mm? -73.23 -16.71 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.459 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -74.35 -43.46 56.52 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.44 -25.81 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.968 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.53 HG13 ' OD1' ' A' ' 56' ' ' ASN . 14.1 tt -73.31 -14.7 16.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.529 0.68 . . . . 0.0 109.957 175.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.614 178.05 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 . . . . . 0 C--O 1.231 0.12 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.77 131.97 49.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.862 0.363 . . . . 0.0 110.823 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.77 134.26 52.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.429 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -136.65 124.85 23.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.575 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.48 HD21 ' CB ' ' A' ' 19' ' ' PHE . 2.7 mm? -67.57 141.04 56.95 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.28 0.562 . . . . 0.0 111.01 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.524 HD11 HG13 ' A' ' 42' ' ' ILE . 39.1 pt -121.33 -2.4 8.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.473 174.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.481 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 95.0 mttt -144.34 149.4 36.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.294 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.39 -28.77 10.1 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.279 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.434 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 80.7 tttt 73.78 -37.12 0.36 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.775 0.83 . . . . 0.0 111.504 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.9 m -151.77 123.57 8.0 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -138.88 139.93 38.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 110.387 -174.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -102.9 123.42 46.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.812 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -117.85 102.06 12.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.2 mtt 63.64 -87.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.058 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.17 0.2 6.51 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.447 ' N ' HD13 ' A' ' 17' ' ' ILE . 3.4 mp -105.31 125.33 60.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.8 m -95.65 117.34 30.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.838 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.565 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 95.8 m-85 -107.04 157.54 17.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.768 0.318 . . . . 0.0 110.914 -178.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -124.8 156.3 38.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.835 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.434 ' CB ' ' HA ' ' A' ' 10' ' ' LYS . . . -71.88 127.91 34.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.817 0.341 . . . . 0.0 110.599 176.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.9 -4.04 78.1 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.234 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 56.8 t -110.99 108.54 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.778 0.323 . . . . 0.0 110.58 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.8 m -78.34 114.65 17.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.538 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.565 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 42.9 mt-30 -117.36 143.99 45.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 0.0 110.988 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.9 m -72.1 131.29 42.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.861 -175.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 m -136.99 154.98 76.46 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.515 ' HD2' HD12 ' A' ' 31' ' ' LEU . 12.9 Cg_exo -71.05 163.6 38.66 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 111.603 174.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -63.04 -26.78 69.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.465 -176.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -67.67 -36.26 80.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.715 0.293 . . . . 0.0 110.923 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.515 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.0 mt -81.1 -31.15 34.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 177.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 56.7 t80 -60.19 -40.56 90.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.565 174.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -71.16 -43.62 67.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.435 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.23 -40.98 87.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.52 -14.81 51.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.939 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -69.01 -28.8 66.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -86.04 1.76 49.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.087 175.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -121.49 94.49 48.55 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 110.475 -173.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.62 61.89 7.0 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 114.976 -168.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.481 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 1.0 OUTLIER -153.22 25.3 0.54 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.261 0.553 . . . . 0.0 110.34 166.571 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -123.98 139.98 53.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.389 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.524 HG13 HD11 ' A' ' 7' ' ' ILE . 11.8 mt -97.2 115.08 35.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 162.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.524 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 32.6 mt -99.75 110.14 22.54 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.218 -174.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.71 -175.801 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.428 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 80.5 Cg_endo . . . . . 0 N--CA 1.475 0.419 0 N-CA-C 114.246 0.825 . . . . 0.0 114.246 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.513 HG12 ' HG2' ' A' ' 97' ' ' GLN . 10.5 tp 179.87 29.98 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.017 0.913 . . . . 0.0 109.842 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -150.63 91.47 1.74 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.905 -173.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -142.74 153.47 43.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.672 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.574 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.6 m -62.44 143.1 57.48 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.688 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.86 -34.69 73.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -70.94 -28.78 64.74 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.615 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.574 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 14.2 mm-40 -71.98 -34.11 68.68 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.02 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.488 HD22 ' SD ' ' A' ' 65' ' ' MET . 95.8 mt -81.85 -20.4 39.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.253 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.688 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 32.0 mmtp -64.96 -28.13 69.31 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.076 0.465 . . . . 0.0 109.814 172.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.49 23.9 33.87 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.293 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.488 ' SD ' HD22 ' A' ' 62' ' ' LEU . 65.8 mtt -122.17 147.56 46.01 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.23 -176.37 4.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.832 0.348 . . . . 0.0 110.808 -178.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.445 ' HZ1' ' CD ' ' A' ' 71' ' ' GLU . 58.5 tttm -52.16 -44.14 64.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.195 -176.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.23 89.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.803 -174.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.462 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.7 OUTLIER -61.84 -50.02 73.96 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.702 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.512 ' O ' HG13 ' A' ' 74' ' ' ILE . 91.2 m-70 -50.56 -46.12 57.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.186 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.473 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 43.1 mt-10 -64.67 -51.27 63.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.74 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.7 t -57.16 -50.11 73.85 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.301 0.376 . . . . 0.0 111.436 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.1 mt -52.84 -61.07 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.638 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.72 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 2.1 mt -77.36 -18.87 14.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.509 -170.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.0 m -69.14 -31.03 69.42 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -72.55 -32.45 66.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.306 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.453 HD23 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -66.39 -38.82 88.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.39 173.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.1 -69.72 0.46 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.083 -0.58 . . . . 0.0 111.816 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.435 ' O ' HG22 ' A' ' 74' ' ' ILE . 39.0 ttm180 -80.27 102.79 9.71 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.417 ' HB2' ' HD2' ' A' ' 81' ' ' PRO . 30.7 p-10 -71.22 155.42 93.07 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.178 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.72 ' HD3' ' HB ' ' A' ' 74' ' ' ILE . 60.0 Cg_endo -73.67 36.76 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.105 2.537 . . . . 0.0 113.91 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.4 t -79.75 -29.86 40.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -71.56 -38.98 70.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.809 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -88.4 108.68 19.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.833 -178.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -71.81 -63.08 1.2 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.228 -172.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -72.11 150.55 43.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.937 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.44 -37.21 80.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.559 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -60.22 -39.21 85.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.907 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -62.55 -38.66 90.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.304 0.573 . . . . 0.0 110.406 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 94' ' ' ILE . 34.4 mtt180 -68.76 -38.46 80.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.951 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.445 HG12 ' HE1' ' A' ' 70' ' ' HIS . 77.8 mt -65.24 -45.4 93.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.143 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.5 90.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.354 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.499 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.5 t80 -66.8 -36.77 83.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.823 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.1 mt -71.92 -46.09 61.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.389 . . . . 0.0 110.365 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.478 HD21 ' HA ' ' A' ' 59' ' ' GLU . 3.7 mm? -65.14 -45.55 84.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.745 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -79.4 -5.4 54.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.369 -0.533 . . . . 0.0 110.472 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.513 ' HG2' HG12 ' A' ' 55' ' ' ILE . 6.0 tp-100 -70.94 -31.9 68.63 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 41.6 mt -65.9 -26.76 39.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.635 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.3 t70 . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.954 179.111 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 67.9 p -108.69 143.6 37.58 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.359 -175.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.39 138.69 52.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.544 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.634 ' HD3' ' HG ' ' A' ' 24' ' ' SER . 28.1 ttpp -141.28 134.74 29.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.584 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 21' ' ' ALA . 3.8 mm? -61.64 123.91 19.22 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.814 0.34 . . . . 0.0 110.646 176.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.518 HG13 ' HD2' ' A' ' 8' ' ' LYS . 13.5 pt -100.65 -23.01 4.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.014 173.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.518 ' HD2' HG13 ' A' ' 7' ' ' ILE . 2.0 mptp? -132.6 122.31 24.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.099 171.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.82 -137.44 8.68 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.218 -0.991 . . . . 0.0 112.888 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.778 ' HG3' ' H ' ' A' ' 11' ' ' THR . 49.6 pttt -168.01 -68.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.778 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.6 p -132.14 118.38 19.53 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -129.77 111.74 12.93 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.511 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 45.3 t-20 -95.92 120.03 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.225 -177.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.47 HG22 HD21 ' A' ' 35' ' ' LEU . 50.5 t -119.13 104.49 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 0.0 110.682 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.2 mtt 62.95 20.14 12.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.124 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.11 -30.19 5.73 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.379 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.29 116.34 30.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.8 m -96.58 108.81 21.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 -177.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -90.08 144.6 25.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.497 ' HG3' HG23 ' A' ' 11' ' ' THR . 10.1 mpt_? -117.06 149.13 40.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.561 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 6' ' ' LEU . . . -63.31 109.82 1.7 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.588 176.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.65 -1.78 39.27 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.193 -178.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.7 t -117.47 125.54 74.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.76 0.314 . . . . 0.0 110.516 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.634 ' HG ' ' HD3' ' A' ' 5' ' ' LYS . 19.4 m -100.04 123.49 44.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.518 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -118.79 150.69 39.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.71 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -92.78 126.65 37.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.213 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.9 m -124.46 157.42 65.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.195 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.528 ' HD2' HD11 ' A' ' 31' ' ' LEU . 38.3 Cg_exo -62.21 156.91 47.72 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.936 2.424 . . . . 0.0 110.974 171.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.576 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -68.08 -15.85 63.77 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -172.772 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -71.65 -43.03 66.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.423 . . . . 0.0 110.026 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.528 HD11 ' HD2' ' A' ' 28' ' ' PRO . 38.0 mt -73.74 -33.69 64.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.902 175.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.576 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 84.4 t80 -53.65 -53.95 44.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.708 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 37' ' ' GLU . 4.2 mm-40 -65.94 -36.7 84.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.581 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -62.45 -45.84 91.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 110.276 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.47 HD21 HG22 ' A' ' 14' ' ' VAL . 95.5 mt -74.08 -25.9 60.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.037 0.446 . . . . 0.0 110.602 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.02 -26.31 68.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.093 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 41.8 mt-10 -77.82 -11.29 59.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.319 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.406 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 35.4 m-80 -102.38 113.81 65.7 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.93 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 19.1 Cg_exo -66.85 -7.39 18.3 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 123.184 2.589 . . . . 0.0 114.546 -173.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -101.62 17.0 23.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.416 -0.513 . . . . 0.0 111.917 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -119.33 131.68 55.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.457 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.509 ' HB ' HG21 ' A' ' 7' ' ' ILE . 14.0 tt -97.19 117.39 41.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.685 0.755 . . . . 0.0 108.998 166.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.451 ' HA ' ' O ' ' A' ' 3' ' ' THR . 4.9 mp -107.07 115.59 30.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.828 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.3 m . . . . . 0 C--N 1.313 -0.986 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.368 -176.208 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.476 ' O ' HG21 ' A' ' 55' ' ' ILE . 96.1 Cg_endo . . . . . 0 N--CA 1.458 -0.615 0 CA-C-O 120.495 0.123 . . . . 0.0 112.387 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.694 HG12 HD23 ' A' ' 77' ' ' LEU . 7.0 tp 52.45 24.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 124.142 0.977 . . . . 0.0 111.766 178.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.526 ' OD1' HG12 ' A' ' 98' ' ' ILE . 7.9 t30 -153.1 83.51 1.2 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.128 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.24 152.45 50.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.113 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.726 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 24.3 m -57.23 138.27 54.9 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.375 0.422 . . . . 0.0 110.247 172.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 1.3 pt-20 -58.78 -30.43 67.55 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.634 ' H ' HG21 ' A' ' 58' ' ' THR . 15.1 m -69.2 -26.95 65.08 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.242 175.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.726 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 8.5 mm-40 -79.19 -44.49 21.78 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-O 121.061 0.458 . . . . 0.0 110.19 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.9 mt -70.77 -20.63 62.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.455 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -65.12 -36.02 82.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.887 -177.195 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.08 42.16 1.96 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.719 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 65.6 mtt -117.53 166.37 12.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.032 0.444 . . . . 0.0 110.996 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.555 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 36.3 m-80 -83.51 162.36 20.93 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.293 174.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -67.21 -38.49 85.39 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.421 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.38 73.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.555 ' HG3' ' HB2' ' A' ' 66' ' ' ASN . 41.7 mt-10 -63.99 -49.89 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.467 ' O ' HG13 ' A' ' 74' ' ' ILE . 34.4 m-70 -54.51 -44.46 72.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.022 173.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.513 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.3 mt-10 -57.81 -44.39 86.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.736 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.6 m -64.94 -45.56 85.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.945 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.0 mt -56.94 -59.71 2.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.347 0.594 . . . . 0.0 111.466 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 70' ' ' HIS . 5.2 mt -73.04 -21.49 19.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.036 -172.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.0 t -66.37 -36.46 82.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 175.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -69.51 -31.94 70.48 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.001 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.694 HD23 HG12 ' A' ' 55' ' ' ILE . 31.6 tp -63.1 -38.03 89.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.376 173.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.38 28.23 2.86 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.948 -177.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.502 ' HD2' ' OH ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -150.49 102.64 3.06 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 177.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -75.0 116.64 56.03 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.227 0.537 . . . . 0.0 110.269 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.513 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 96.0 Cg_endo -79.61 29.52 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 123.067 2.512 . . . . 0.0 112.738 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.96 -17.57 64.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.04 -27.25 30.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -82.43 109.05 16.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.733 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' HB3' ' HZ3' ' A' ' 85' ' ' LYS . 3.2 mmmp? -71.73 -40.29 69.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.809 -174.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.522 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 19.2 m-80 -91.88 166.99 12.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.95 0.405 . . . . 0.0 110.148 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -85.77 -22.7 27.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.759 -178.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -63.0 -49.07 76.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.202 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.522 ' OE1' ' HB2' ' A' ' 86' ' ' ASN . 2.0 mp0 -58.57 -35.33 72.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.096 0.474 . . . . 0.0 110.615 177.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.477 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.0 mtt180 -66.14 -38.61 88.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.042 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 87' ' ' ALA . 77.0 mt -66.85 -45.06 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.008 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.23 99.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.427 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.502 ' OH ' ' HD2' ' A' ' 79' ' ' ARG . 64.3 t80 -65.95 -36.81 84.36 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.899 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 90' ' ' ARG . 77.5 mt -66.88 -36.4 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.147 177.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.473 HD23 HD13 ' A' ' 98' ' ' ILE . 85.4 mt -62.57 -28.07 69.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.749 174.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.15 -30.41 71.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.548 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.67 -31.76 57.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.478 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.526 HG12 ' OD1' ' A' ' 56' ' ' ASN . 45.0 mt -66.2 -34.66 71.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.633 0.73 . . . . 0.0 109.805 174.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t70 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.407 177.012 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.545 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 63.8 m-85 . . . . . 0 N--CA 1.454 -0.259 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.9 p -111.09 122.88 49.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.01 0.433 . . . . 0.0 110.954 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.21 127.64 54.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.351 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -121.22 118.33 29.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.834 0.35 . . . . 0.0 110.724 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -66.92 126.84 30.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.525 HD13 HG13 ' A' ' 42' ' ' ILE . 26.4 pt -116.99 -33.06 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.862 0.363 . . . . 0.0 111.959 -175.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.441 ' N ' HG13 ' A' ' 7' ' ' ILE . 61.2 tttp -111.97 102.52 10.74 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -176.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.86 -119.0 1.47 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.411 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -176.5 -65.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -173.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 m -137.78 123.21 19.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.7 177.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -127.64 146.82 50.42 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -175.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -119.44 117.26 27.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.606 0.241 . . . . 0.0 110.544 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -115.23 101.39 12.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.6 mtt 62.73 -86.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.31 178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.67 9.15 6.13 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.272 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.4 HD13 ' N ' ' A' ' 17' ' ' ILE . 4.4 mp -118.96 126.45 75.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.1 m -99.11 128.22 45.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.4 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -109.86 139.13 45.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.47 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.5 mtm-85 -116.49 142.43 46.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.17 117.3 3.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 111.623 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.87 0.34 55.12 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.765 -0.731 . . . . 0.0 113.045 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -109.55 116.44 52.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 111.005 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.6 m -83.2 106.75 15.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.728 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -109.84 139.42 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.525 -176.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -71.99 120.27 17.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.003 0.43 . . . . 0.0 110.533 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.8 m -112.98 158.32 38.16 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.339 -175.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.514 ' HD2' HD13 ' A' ' 31' ' ' LEU . 34.0 Cg_exo -62.37 150.68 86.36 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.624 2.216 . . . . 0.0 111.293 172.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -59.12 -29.99 67.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.425 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.84 -44.6 85.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 0.0 110.693 176.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.514 HD13 ' HD2' ' A' ' 28' ' ' PRO . 62.6 mt -76.07 -20.76 57.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.297 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.545 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 73.8 t80 -60.8 -47.86 84.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.895 0.379 . . . . 0.0 110.06 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -73.19 -35.36 66.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.058 0.456 . . . . 0.0 110.024 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.5 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 83.3 t80 -59.92 -29.83 68.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.746 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.4 mt -94.66 -16.26 23.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.003 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.32 -29.79 67.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.637 0.732 . . . . 0.0 109.821 177.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -90.6 7.46 39.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.253 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -115.18 106.64 50.92 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.611 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -76.58 40.67 0.8 Allowed 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.561 2.84 . . . . 0.0 115.337 -165.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.44 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 2.1 p90 -149.01 25.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 173.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.457 ' CZ ' HD21 ' A' ' 6' ' ' LEU . 61.6 m-85 -127.06 138.61 53.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.226 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.525 HG13 HD13 ' A' ' 7' ' ' ILE . 46.8 mt -96.67 113.29 30.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 18.4 mt -100.32 107.79 19.67 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.763 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.443 -0.814 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.652 178.226 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo . . . . . 0 CA--C 1.531 0.346 0 N-CA-C 114.033 0.743 . . . . 0.0 114.033 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.65 HG12 HD13 ' A' ' 77' ' ' LEU . 10.2 tp -174.81 30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.899 0.856 . . . . 0.0 109.314 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -159.0 94.72 1.23 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.996 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -138.08 157.0 47.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.839 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.903 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.5 m -63.77 134.09 54.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 173.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 13.0 pt-20 -59.42 -33.45 71.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 p -69.22 -30.0 68.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.24 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.903 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 59.3 mm-40 -73.17 -37.25 66.61 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.635 176.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.548 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 97.6 mt -77.48 -15.34 59.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.581 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 27.4 mmtp -70.79 -37.24 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.753 0.311 . . . . 0.0 111.06 176.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.4 39.3 3.0 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.555 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 64.4 mtt -137.21 172.82 12.43 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.78 -157.51 0.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -68.62 -42.22 78.39 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.588 -175.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.62 62.78 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.488 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.8 mp0 -52.35 -55.88 18.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.971 0.415 . . . . 0.0 110.392 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.588 ' HE1' HG12 ' A' ' 91' ' ' ILE . 28.0 m-70 -58.96 -44.6 91.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.831 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 63.5 mt-10 -63.63 -41.46 98.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.772 -0.195 . . . . 0.0 111.108 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.1 p -65.34 -34.62 78.75 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.521 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.506 HD11 ' HA ' ' A' ' 70' ' ' HIS . 96.6 mt -58.81 -57.59 10.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.962 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.58 HG13 ' O ' ' A' ' 70' ' ' HIS . 1.3 mt -72.55 -16.1 17.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.862 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 66.7 m -67.9 -36.51 80.33 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -66.44 -34.52 78.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.007 173.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.65 HD13 HG12 ' A' ' 55' ' ' ILE . 46.3 tp -63.59 -38.37 90.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.008 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 104.06 23.8 7.96 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.083 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.466 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 0.1 OUTLIER -131.66 126.23 34.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.727 0.298 . . . . 0.0 110.269 -178.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -73.89 136.51 76.77 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.888 178.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.474 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 5.0 Cg_exo -80.23 49.46 3.21 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.082 2.521 . . . . 0.0 111.329 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -49.75 -54.29 19.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.153 -170.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -106.27 24.73 12.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.338 0.589 . . . . 0.0 110.964 -174.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -107.61 120.27 41.76 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.462 ' HG2' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -115.56 -32.86 5.41 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.918 -175.02 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.58 169.59 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.543 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -72.98 -41.26 64.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.671 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.19 -44.8 88.23 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.632 0.582 . . . . 0.0 111.628 -177.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.462 ' OE1' ' HG2' ' A' ' 85' ' ' LYS . 33.3 mt-10 -58.09 -38.78 77.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 110.55 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.517 ' HD3' ' HB2' ' A' ' 70' ' ' HIS . 73.0 mtt85 -72.81 -32.04 65.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.711 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.588 HG12 ' HE1' ' A' ' 70' ' ' HIS . 75.8 mt -67.49 -47.15 81.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.15 -44.77 75.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.189 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.466 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 37.0 t80 -65.05 -40.51 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.92 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.484 ' O ' HG13 ' A' ' 98' ' ' ILE . 86.9 mt -67.52 -44.31 86.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.425 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.451 HD11 HD12 ' A' ' 98' ' ' ILE . 3.7 mm? -62.61 -41.37 98.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.292 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -65.32 -28.0 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 110.991 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -19.4 46.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.915 0.388 . . . . 0.0 110.39 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 94' ' ' ILE . 75.9 mt -74.27 -42.2 50.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 172.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.28 176.747 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 . . . . . 0 CA--C 1.516 -0.338 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.615 ' HB ' ' HB ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -116.28 134.86 54.44 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -170.037 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.65 118.66 28.66 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 174.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 38.9 ttpt -119.11 126.4 51.54 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.835 0.35 . . . . 0.0 110.332 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.631 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -66.02 125.33 25.12 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.403 HG13 ' HG3' ' A' ' 8' ' ' LYS . 29.3 pt -111.9 -30.91 2.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.267 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HG3' HG13 ' A' ' 7' ' ' ILE . 64.2 mttp -127.89 111.53 13.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.781 0.324 . . . . 0.0 110.726 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.47 -13.29 3.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.658 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.459 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 61.5 mttp 71.39 -51.02 0.69 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.496 0.719 . . . . 0.0 111.922 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -150.35 129.45 12.69 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.741 0.305 . . . . 0.0 110.349 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -156.77 129.71 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -111.19 146.15 37.4 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.913 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.433 HG21 HD22 ' A' ' 35' ' ' LEU . 44.6 t -127.93 99.25 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.274 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 61.9 mtm 57.74 49.55 12.1 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.855 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.49 -35.58 4.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.603 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.473 HD13 HD12 ' A' ' 31' ' ' LEU . 4.0 mp -80.24 108.76 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.2 m -91.44 126.77 36.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.017 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.48 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 71.7 m-85 -108.03 146.04 33.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.81 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -133.87 154.88 50.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.688 0.28 . . . . 0.0 110.972 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.631 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -60.76 105.34 0.44 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.081 178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.74 11.17 47.89 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.688 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.67 108.21 24.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.887 0.375 . . . . 0.0 110.632 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.419 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 15.2 m -74.95 122.13 22.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.592 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -121.51 129.13 52.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.504 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.5 p -74.42 129.91 38.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.732 0.301 . . . . 0.0 110.351 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -120.73 153.4 56.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.468 -174.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.51 ' HD2' HD11 ' A' ' 31' ' ' LEU . 19.5 Cg_exo -67.12 164.99 28.03 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.714 2.276 . . . . 0.0 111.167 171.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.41 -29.99 70.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.858 0.361 . . . . 0.0 110.938 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -64.72 -50.16 68.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.713 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.51 HD11 ' HD2' ' A' ' 28' ' ' PRO . 45.2 mt -71.72 -29.41 64.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.503 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -55.44 -51.36 67.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.523 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 44.8 mt-10 -75.42 -31.25 60.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.98 0.419 . . . . 0.0 110.776 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -61.46 -33.36 73.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.303 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.529 HD21 ' CE1' ' A' ' 41' ' ' PHE . 93.2 mt -98.69 -12.61 20.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.982 177.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.452 ' HB3' ' HA ' ' A' ' 33' ' ' GLU . 5.8 t30 -61.22 -36.16 79.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.565 0.698 . . . . 0.0 109.882 173.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -87.12 13.41 9.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.266 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.58 122.96 31.07 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.792 0.329 . . . . 0.0 110.352 177.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -88.64 22.42 0.86 Allowed 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.992 2.461 . . . . 0.0 114.101 -174.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -127.58 21.49 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.188 0.518 . . . . 0.0 111.669 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.529 ' CE1' HD21 ' A' ' 35' ' ' LEU . 73.9 m-85 -128.49 145.49 51.09 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.9 tt -97.33 124.32 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 171.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 36' ' ' ASN . 12.5 mt -100.84 108.37 20.15 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.141 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.615 ' HB ' ' HB ' ' A' ' 3' ' ' THR . 20.8 m . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.818 -174.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.44 ' O ' HG21 ' A' ' 55' ' ' ILE . 20.0 Cg_exo . . . . . 0 N--CA 1.465 -0.185 0 N-CA-C 111.754 -0.133 . . . . 0.0 111.754 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.778 HG12 HD21 ' A' ' 77' ' ' LEU . 10.8 tp 49.02 25.61 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-O 121.915 0.864 . . . . 0.0 111.458 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -141.62 96.46 2.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.819 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.44 ' HB2' HD13 ' A' ' 62' ' ' LEU . 83.8 m-85 -140.6 161.91 36.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.709 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.642 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 1.1 m -61.88 133.58 55.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.484 ' HG3' ' N ' ' A' ' 60' ' ' SER . 0.6 OUTLIER -66.5 -32.95 74.63 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.969 -0.693 . . . . 0.0 109.706 -179.115 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.484 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 10.8 m -69.73 -24.83 63.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.223 0.535 . . . . 0.0 109.819 174.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.642 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 59.4 tt0 -81.66 -35.52 29.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.849 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.44 HD13 ' HB2' ' A' ' 57' ' ' TYR . 96.3 mt -83.06 -6.32 59.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.718 175.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HD2' HD11 ' A' ' 91' ' ' ILE . 15.5 tptt -66.25 -27.1 67.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.626 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.21 -119.01 4.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 173.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.2 mmt 59.74 -158.17 0.32 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.423 0.63 . . . . 0.0 111.927 174.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.741 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 42.9 t-20 -123.64 158.66 31.03 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.96 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -67.27 -36.36 81.4 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 71' ' ' GLU . . . -61.85 -32.77 73.14 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.131 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.741 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 12.5 mm-40 -62.66 -56.67 15.62 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.663 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.8 m80 -51.45 -40.61 59.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.963 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 45.1 mm-40 -51.84 -64.99 0.64 Allowed 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.302 0.376 . . . . 0.0 110.549 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.8 m -56.91 -44.47 82.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.216 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.2 mt -53.28 -57.22 5.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.648 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.663 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.2 mt -82.05 -20.96 10.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.753 -172.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.51 -33.38 74.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -73.38 -27.76 61.65 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.778 HD21 HG12 ' A' ' 55' ' ' ILE . 56.7 tp -65.89 -29.75 70.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.97 0.414 . . . . 0.0 110.173 172.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.84 9.38 26.56 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.466 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -133.47 97.82 4.05 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 14.5 m120 -68.42 131.8 91.59 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.698 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 80' ' ' ASN . 57.1 Cg_endo -88.92 65.39 2.75 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.924 2.416 . . . . 0.0 112.379 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.1 t -86.36 -31.7 21.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.471 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -90.05 -25.01 21.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.937 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -82.32 108.65 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -92.69 -61.92 1.5 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.52 -168.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -72.81 163.72 27.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.04 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.517 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -63.64 -45.73 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.52 -174.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.512 ' HA ' HD12 ' A' ' 91' ' ' ILE . 10.3 t70 -65.97 -32.27 73.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.077 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.37 -44.0 96.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.544 0.688 . . . . 0.0 110.074 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -68.57 -34.83 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.24 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 87' ' ' ALA . 86.3 mt -65.8 -41.51 90.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.12 176.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.34 83.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.71 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -63.33 -44.76 93.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.623 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.487 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.0 mt -61.33 -45.56 98.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.206 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -47.95 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.562 -177.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.0 mttp -67.13 -20.87 65.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.16 -40.49 27.2 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 94' ' ' ILE . 83.4 mt -63.74 -35.32 72.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.456 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.8 t70 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.199 -179.768 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 . . . . . 0 C--O 1.232 0.179 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.629 ' OG1' ' HB ' ' A' ' 44' ' ' THR . 73.9 p -131.59 155.48 47.44 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.686 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -126.84 137.8 53.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.224 177.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.46 ' HB2' ' OG ' ' A' ' 24' ' ' SER . 5.8 ttpm? -120.73 116.97 26.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.104 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.589 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -67.99 124.28 22.95 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.564 HG13 ' N ' ' A' ' 8' ' ' LYS . 18.9 pt -117.61 -36.67 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.909 0.385 . . . . 0.0 111.695 -177.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.564 ' N ' HG13 ' A' ' 7' ' ' ILE . 44.9 tttm -92.06 30.56 1.4 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.747 -167.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.1 -126.7 0.85 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.62 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.436 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 9.2 ptpp? -160.13 -44.45 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.7 m -152.99 125.01 7.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.989 174.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -140.01 117.55 11.49 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -91.22 115.87 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.3 t -106.38 97.29 5.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.726 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 62.8 mtt 59.39 22.65 11.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.931 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 121.6 -33.75 4.18 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.578 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.9 mm -78.32 108.79 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.3 m -91.06 101.22 13.97 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.702 0.286 . . . . 0.0 110.759 -175.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 98.4 m-85 -86.06 144.37 27.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.587 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -124.97 143.26 50.98 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -51.71 118.27 3.26 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.67 4.03 59.33 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.768 -0.651 . . . . 0.0 113.224 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.5 t -117.75 112.1 37.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 117.024 0.412 . . . . 0.0 111.523 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 71.5 m -74.45 116.47 15.16 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.896 171.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.492 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 25.6 mt-30 -116.3 146.78 42.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.498 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.519 ' HA ' HG23 ' A' ' 3' ' ' THR . 13.0 p -67.51 131.81 46.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.127 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 35.6 m -134.7 144.83 52.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.922 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.525 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.7 Cg_exo -66.96 161.77 41.0 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.627 2.218 . . . . 0.0 110.883 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -59.02 -31.53 68.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.613 0.245 . . . . 0.0 111.469 -176.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.51 -48.49 79.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.862 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.525 HD12 ' HD2' ' A' ' 28' ' ' PRO . 68.9 mt -73.4 -29.01 62.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.667 0.27 . . . . 0.0 110.537 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -55.6 -48.95 74.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.962 174.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -71.56 -34.87 70.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.309 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 66.8 t80 -64.94 -40.84 95.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.595 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.489 HD21 ' CE1' ' A' ' 41' ' ' PHE . 73.6 mt -81.93 -20.13 39.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.741 0.305 . . . . 0.0 110.629 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -66.32 -26.05 67.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.679 0.752 . . . . 0.0 109.051 169.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 34' ' ' TYR . 13.7 tp10 -79.4 -15.42 57.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.929 176.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.478 ' HB3' ' CD2' ' A' ' 40' ' ' TYR . 40.4 m-80 -115.14 113.18 43.85 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.532 -174.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 2.8 Cg_exo -75.32 41.34 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.016 2.477 . . . . 0.0 114.105 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.478 ' CD2' ' HB3' ' A' ' 38' ' ' ASN . 9.1 m-85 -111.75 -6.26 14.34 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.926 0.393 . . . . 0.0 110.001 176.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.489 ' CE1' HD21 ' A' ' 35' ' ' LEU . 78.7 m-85 -124.41 141.79 51.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.783 -169.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.495 HG13 HD13 ' A' ' 7' ' ' ILE . 68.9 mt -110.57 111.25 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 164.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 6.3 mp -82.91 148.52 27.63 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 120.955 0.407 . . . . 0.0 111.193 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.629 ' HB ' ' OG1' ' A' ' 3' ' ' THR . 17.7 m . . . . . 0 C--N 1.318 -0.794 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.675 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.462 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 2.7 Cg_exo . . . . . 0 N--CA 1.461 -0.44 0 CA-C-O 120.763 0.235 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.448 HG12 HD12 ' A' ' 77' ' ' LEU . 10.4 tp -171.33 21.2 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 122.46 1.124 . . . . 0.0 108.998 174.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.461 ' HA ' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -153.29 100.17 2.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.901 -175.071 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.403 ' HB2' HD11 ' A' ' 62' ' ' LEU . 90.9 m-85 -142.66 177.83 8.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.316 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.637 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -76.76 133.37 39.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.928 177.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.423 ' O ' ' HE2' ' A' ' 63' ' ' LYS . 4.2 pt-20 -66.97 -33.01 74.65 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.46 -178.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 11.5 p -74.28 -22.71 59.17 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.863 ' HG2' ' HE1' ' A' ' 65' ' ' MET . 53.9 tt0 -80.19 -40.58 26.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.452 176.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 81.0 mt -75.85 -9.98 59.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.746 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 59' ' ' GLU . 7.6 tppt? -66.39 -19.84 65.91 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.13 -113.23 2.11 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.52 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.863 ' HE1' ' HG2' ' A' ' 61' ' ' GLU . 47.7 mtt 62.13 -175.4 0.14 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.53 0.681 . . . . 0.0 111.562 -177.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.66 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 46.4 t30 -95.49 151.41 19.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.279 174.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.508 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 51.8 mtmt -54.1 -48.24 70.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.805 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.4 -30.39 64.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.088 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.66 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 7.0 mm-40 -63.67 -52.02 62.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.441 ' HE1' ' O ' ' A' ' 62' ' ' LEU . 77.7 m-70 -55.79 -44.21 77.57 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.49 -43.45 97.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.611 -177.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -64.19 -40.61 96.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.757 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.4 mt -51.99 -62.15 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.13 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.4 OUTLIER -76.45 -16.93 15.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.935 -174.035 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.0 t -66.34 -35.2 79.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -32.02 60.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.353 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.448 HD12 HG12 ' A' ' 55' ' ' ILE . 47.1 tp -63.51 -36.21 83.03 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.151 0.5 . . . . 0.0 110.404 174.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.9 5.3 33.41 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.112 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.13 119.5 39.48 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -63.07 122.57 75.99 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.053 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.72 -3.33 11.76 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.189 2.592 . . . . 0.0 111.926 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.0 m -68.34 -12.2 60.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.965 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.97 -34.37 71.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.188 0.518 . . . . 0.0 110.559 175.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.601 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . 57.8 m-85 -100.23 122.75 43.53 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.95 -171.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -82.33 -40.19 21.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.304 -178.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.837 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 94.6 m-20 -96.38 162.16 13.61 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.047 0.451 . . . . 0.0 111.597 -176.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.451 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -70.62 -36.08 73.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.54 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -63.92 -36.86 85.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.428 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.837 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 21.1 mm-40 -59.45 -40.37 86.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.368 0.604 . . . . 0.0 109.75 176.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.433 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.9 mtt85 -63.81 -49.14 74.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.619 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 87' ' ' ALA . 61.8 mt -60.08 -42.85 91.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.171 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.19 77.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.379 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -78.05 -41.15 36.42 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.519 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.55 ' O ' HG13 ' A' ' 98' ' ' ILE . 70.1 mt -62.49 -44.67 99.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.518 ' HA ' HD12 ' A' ' 98' ' ' ILE . 14.9 mt -62.23 -29.23 70.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.625 176.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HZ3' ' HB2' ' A' ' 96' ' ' LYS . 3.9 ttmp? -61.84 -42.37 98.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.775 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -81.1 -20.12 42.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.55 HG13 ' O ' ' A' ' 94' ' ' ILE . 96.6 mt -71.75 -44.27 68.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.127 0.489 . . . . 0.0 110.09 176.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.372 179.283 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 70.3 m-85 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 120.728 0.299 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -131.69 135.47 46.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.026 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.17 122.51 47.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.183 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.518 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 88.6 tttt -109.01 107.23 17.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.421 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.621 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -65.84 122.3 17.01 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.524 HD13 HG13 ' A' ' 42' ' ' ILE . 43.2 pt -113.78 -24.14 3.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -178.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -102.59 105.16 15.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -176.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 116.58 -129.84 8.65 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.474 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 97.9 mttt -154.68 -46.18 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.9 p -136.21 153.82 51.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.645 172.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -162.41 116.45 1.79 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.757 0.313 . . . . 0.0 110.159 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.6 t-20 -90.76 112.31 24.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -178.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.472 HG13 HD23 ' A' ' 35' ' ' LEU . 54.9 t -104.2 108.69 25.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.793 177.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 65.41 -75.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.795 0.684 . . . . 0.0 111.364 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.85 6.19 1.81 Allowed Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.607 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 17' ' ' ILE . 4.2 mp -115.84 119.39 61.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 22.2 m -92.83 105.7 17.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.972 0.415 . . . . 0.0 110.585 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -84.64 161.82 19.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.414 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.423 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 62.6 mtt180 -133.66 136.99 45.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.446 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.621 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.29 109.49 0.55 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.817 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.17 -7.55 30.85 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.516 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.6 t -111.21 127.2 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -179.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.518 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 12.1 p -102.95 104.21 14.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.42 177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -102.02 149.83 23.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 0.0 110.819 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -73.52 132.74 43.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.814 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.8 m -126.9 155.35 75.69 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.328 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.508 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -64.26 151.93 83.39 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.692 2.261 . . . . 0.0 110.962 172.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -20.78 66.54 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -68.5 -45.86 71.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.354 0.597 . . . . 0.0 110.228 174.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.508 HD12 ' HD2' ' A' ' 28' ' ' PRO . 77.7 mt -75.18 -26.22 58.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.499 -179.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.469 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 84.9 t80 -57.32 -50.76 71.93 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.327 177.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 8.0 mm-40 -70.86 -33.43 70.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.131 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -62.31 -46.14 90.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 110.656 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.507 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.9 mt -79.24 -19.46 50.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.058 0.456 . . . . 0.0 110.344 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 32.7 t30 -62.97 -31.87 73.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.798 174.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.48 -1.12 55.22 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.877 176.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -123.48 117.72 27.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 111.682 -174.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.57 39.47 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 123.293 2.662 . . . . 0.0 113.851 -175.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.425 ' HB2' ' CD1' ' A' ' 41' ' ' PHE . 72.4 m-85 -98.38 -18.44 18.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.066 0.46 . . . . 0.0 110.208 176.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.507 ' CE1' HD22 ' A' ' 35' ' ' LEU . 68.3 m-85 -127.35 147.24 50.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.778 -169.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.524 HG13 HD13 ' A' ' 7' ' ' ILE . 60.0 mt -97.71 103.72 15.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 162.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.417 HD23 ' HB2' ' A' ' 35' ' ' LEU . 5.3 mp -87.06 131.24 34.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.608 -174.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.2 m . . . . . 0 C--N 1.318 -0.766 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.613 -177.792 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo . . . . . 0 N--CA 1.461 -0.404 0 N-CA-C 111.154 -0.364 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.662 HG22 HD13 ' A' ' 77' ' ' LEU . 11.2 tp -174.89 31.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 122.418 1.104 . . . . 0.0 108.397 -178.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -149.57 96.57 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.91 -173.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -142.72 165.67 26.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.537 -176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.6 m -64.9 129.81 41.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.353 175.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.4 pm0 -61.77 -38.59 88.59 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 179.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.8 m -62.26 -30.97 71.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -78.44 -35.0 47.46 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.348 0.594 . . . . 0.0 109.83 178.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.7 mt -77.64 -14.8 59.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.97 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 70.8 mmtt -66.06 -27.73 68.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.436 ' O ' ' HB3' ' A' ' 65' ' ' MET . . . -97.72 -148.52 23.96 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 169.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.454 ' HG3' ' OE1' ' A' ' 69' ' ' GLU . 43.6 ttm 68.75 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.106 0.479 . . . . 0.0 111.128 175.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -73.5 163.28 28.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.536 . . . . 0.0 111.153 -174.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -56.83 -41.41 77.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.156 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.36 90.87 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.221 0.326 . . . . 0.0 111.38 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.454 ' OE1' ' HG3' ' A' ' 65' ' ' MET . 47.7 mt-10 -60.1 -56.31 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.429 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.627 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.7 m-70 -51.11 -42.22 60.52 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.212 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.5 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 38.7 mt-10 -68.59 -41.52 79.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.748 -177.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 27.2 t -63.34 -41.64 98.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 69' ' ' GLU . 76.0 mt -52.95 -58.86 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.403 176.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.627 HG13 ' O ' ' A' ' 70' ' ' HIS . 7.2 mt -72.28 -24.25 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.528 -173.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.517 ' HA ' ' O ' ' A' ' 79' ' ' ARG . 49.9 m -74.94 -33.12 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.987 0.423 . . . . 0.0 110.008 175.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.1 -31.05 71.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.228 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.662 HD13 HG22 ' A' ' 55' ' ' ILE . 35.4 tp -61.62 -29.44 70.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.002 174.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 118.72 -7.07 13.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.934 -0.651 . . . . 0.0 111.507 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 mmt180 -90.49 -172.78 3.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.699 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 3.9 t-20 -150.8 109.29 3.09 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.68 178.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.5 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 5.2 Cg_exo -77.79 54.0 4.63 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 123.218 2.612 . . . . 0.0 112.896 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.0 p -83.61 -37.32 23.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.22 0.533 . . . . 0.0 110.568 177.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -93.94 7.32 45.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.447 0.641 . . . . 0.0 110.48 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -105.5 108.53 20.1 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -97.42 -45.05 6.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -171.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.544 ' HB2' ' HG3' ' A' ' 89' ' ' GLU . 39.2 m-80 -80.53 168.01 19.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.234 0.54 . . . . 0.0 111.541 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' ' 90' ' ' ARG . . . -81.05 -36.92 29.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.507 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.524 ' HA ' HD11 ' A' ' 91' ' ' ILE . 18.5 t70 -70.94 -32.77 69.75 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.863 -178.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.544 ' HG3' ' HB2' ' A' ' 86' ' ' ASN . 50.8 mt-10 -59.5 -46.33 89.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 110.748 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 18.2 ptp180 -71.3 -27.55 63.49 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.528 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.524 HD11 ' HA ' ' A' ' 88' ' ' ASP . 96.6 mt -65.43 -45.95 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.89 -42.81 80.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.769 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.411 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 42.3 t80 -68.22 -39.15 82.43 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.793 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.5 mt -66.04 -37.97 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.899 0.381 . . . . 0.0 110.283 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD21 HD13 ' A' ' 98' ' ' ILE . 13.3 mt -65.29 -37.5 87.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.402 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.9 tmtm? -59.06 -31.15 68.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.939 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.604 ' HG3' ' CG1' ' A' ' 55' ' ' ILE . 7.5 mm-40 -74.27 -30.94 62.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.487 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.488 HD13 HD21 ' A' ' 95' ' ' LEU . 56.0 mt -67.65 -28.16 40.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.373 177.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.96 0.409 . . . . 0.0 110.538 176.845 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.532 ' O ' ' HA ' ' A' ' 26' ' ' THR . 90.0 m-85 . . . . . 0 CA--C 1.52 -0.19 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.405 HG23 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -106.79 131.7 53.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.789 -177.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.47 137.28 53.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.172 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -139.59 137.91 35.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.757 0.313 . . . . 0.0 111.08 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -65.11 118.58 9.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.653 174.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.572 HG21 ' HB ' ' A' ' 42' ' ' ILE . 36.3 pt -100.26 -6.34 9.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.502 0.667 . . . . 0.0 109.796 175.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.6 tttp -140.19 130.79 25.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.483 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 109.12 -132.82 11.29 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.315 -0.945 . . . . 0.0 112.42 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -164.32 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.618 0.247 . . . . 0.0 110.364 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.48 HG23 ' HG2' ' A' ' 20' ' ' ARG . 12.4 p -145.16 134.99 23.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.238 179.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -147.18 128.07 14.44 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -97.5 107.86 20.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.793 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.543 HG21 HD21 ' A' ' 35' ' ' LEU . 61.6 t -96.55 95.16 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.1 mtt 65.7 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.099 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -133.56 -1.87 3.73 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.938 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.475 ' N ' HD13 ' A' ' 17' ' ' ILE . 3.4 mp -102.06 113.81 39.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.5 m -87.99 116.55 26.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.733 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -98.59 151.09 21.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.735 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.48 ' HG2' HG23 ' A' ' 11' ' ' THR . 15.5 mtp180 -132.32 137.84 47.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 109.9 1.02 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.028 0.442 . . . . 0.0 111.037 177.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.2 -3.32 28.32 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.308 -178.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -118.81 113.84 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.831 0.348 . . . . 0.0 111.026 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.405 ' HB3' HG23 ' A' ' 3' ' ' THR . 33.6 m -85.09 126.05 33.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.262 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -129.17 151.48 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.37 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 1.2 p -80.92 138.59 36.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.855 0.359 . . . . 0.0 111.806 -176.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.9 153.4 81.7 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.959 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.468 ' HD2' HD11 ' A' ' 31' ' ' LEU . 7.6 Cg_exo -74.29 171.39 18.14 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 123.05 2.5 . . . . 0.0 112.264 175.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -51.9 -46.76 64.71 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.968 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.19 -45.34 94.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.411 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.468 HD11 ' HD2' ' A' ' 28' ' ' PRO . 62.8 mt -73.12 -28.93 62.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -58.44 -47.01 85.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -68.11 -41.29 81.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.575 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.98 -45.56 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.845 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.543 HD21 HG21 ' A' ' 14' ' ' VAL . 87.2 mt -76.83 -23.44 52.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.84 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.69 -29.59 70.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.362 0.601 . . . . 0.0 109.705 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -78.07 -6.69 55.41 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 38.1 m-80 -118.87 101.5 50.23 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.61 -177.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 14.2 Cg_exo -69.42 11.66 0.35 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.523 2.816 . . . . 0.0 114.735 -171.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.5 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 17.7 p90 -105.18 10.57 33.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.258 0.552 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.439 ' CE2' HD23 ' A' ' 35' ' ' LEU . 45.1 m-85 -117.07 136.29 53.09 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.885 172.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.572 ' HB ' HG21 ' A' ' 7' ' ' ILE . 9.9 tt -97.25 133.5 38.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 167.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mp -120.79 141.56 50.4 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.162 0.506 . . . . 0.0 110.554 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.314 -0.944 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.586 179.807 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.445 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 74.4 Cg_endo . . . . . 0 N--CA 1.453 -0.868 0 N-CA-C 113.633 0.59 . . . . 0.0 113.633 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.504 HG12 HD13 ' A' ' 77' ' ' LEU . 9.3 tp 179.66 26.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.968 0.89 . . . . 0.0 109.666 174.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.439 ' HB2' HG12 ' A' ' 98' ' ' ILE . 6.5 p30 -161.88 105.3 1.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.793 -175.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.504 ' HB2' ' HG ' ' A' ' 62' ' ' LEU . 68.5 m-85 -142.89 161.65 37.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.039 -177.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 60' ' ' SER . 13.9 m -60.43 142.97 54.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.595 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 2.5 pp20? -60.01 -36.95 78.32 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.418 ' H ' HG23 ' A' ' 58' ' ' THR . 6.5 m -67.53 -29.19 68.53 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.187 176.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.433 ' HG2' ' HE2' ' A' ' 65' ' ' MET . 33.5 tt0 -77.24 -34.51 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.88 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.504 ' HG ' ' HB2' ' A' ' 57' ' ' TYR . 87.5 mt -77.18 -21.24 54.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.11 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.595 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 29.4 mmtp -62.12 -40.24 95.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.906 172.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.82 47.68 2.5 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.155 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.474 ' SD ' HD22 ' A' ' 62' ' ' LEU . 65.9 mtt -141.03 136.52 32.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.449 ' ND2' ' HG2' ' A' ' 69' ' ' GLU . 11.2 p30 -71.17 173.2 7.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.015 0.436 . . . . 0.0 110.728 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.37 -41.21 94.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.009 -175.255 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.87 79.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.599 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.548 ' O ' HG13 ' A' ' 73' ' ' ILE . 58.7 mm-40 -59.6 -52.85 63.76 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.517 ' O ' HG13 ' A' ' 74' ' ' ILE . 32.2 m-70 -52.46 -41.7 63.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.604 178.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 54.3 mt-10 -66.38 -45.64 79.38 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.709 -177.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.0 m -59.13 -47.0 86.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.666 0.269 . . . . 0.0 110.565 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.3 mt -50.99 -62.32 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.75 -178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.7 mt -74.59 -24.69 18.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.21 -172.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.0 t -68.04 -29.75 68.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.92 -25.17 43.69 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.911 0.386 . . . . 0.0 110.257 176.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.504 HD13 HG12 ' A' ' 55' ' ' ILE . 37.8 tp -67.59 -37.84 83.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.941 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.59 -1.49 10.26 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.688 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -107.1 133.71 51.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.848 0.356 . . . . 0.0 110.93 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.554 ' OD1' ' HB3' ' A' ' 82' ' ' SER . 23.9 t-20 -66.19 117.46 43.3 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.462 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.78 -5.6 17.49 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.632 2.221 . . . . 0.0 112.913 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.554 ' HB3' ' OD1' ' A' ' 80' ' ' ASN . 42.1 t -80.31 -9.01 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 177.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -69.57 -21.67 63.6 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -112.67 108.62 17.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.288 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -83.12 -41.72 18.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.259 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -89.36 150.48 22.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.068 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -37.96 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.355 176.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.32 -52.0 60.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.575 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -61.23 -43.57 98.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.025 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 94' ' ' ILE . 94.6 mtt180 -64.3 -41.89 96.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.319 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -66.77 -45.71 87.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.137 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 -38.65 80.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.818 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -70.91 -39.18 72.89 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.921 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.4 mt -66.07 -32.5 58.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.228 0.537 . . . . 0.0 109.94 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 98' ' ' ILE . 4.0 mm? -73.86 -21.25 60.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.968 174.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -68.85 -33.05 73.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.717 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.435 HE21 HG13 ' A' ' 55' ' ' ILE . 2.6 mp0 -67.75 -36.35 80.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 109.988 175.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 95' ' ' LEU . 43.2 mt -67.61 -32.54 57.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.149 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.0 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.614 174.363 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.545 0.212 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.6 p -121.29 132.22 54.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.139 0.495 . . . . 0.0 110.943 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.6 128.87 55.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.356 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 6.0 ttpm? -114.13 121.63 44.36 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.626 0.25 . . . . 0.0 110.502 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.619 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 55.2 tp -62.84 124.95 22.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.99 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.0 pt -120.43 5.42 6.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.761 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -132.89 104.76 6.74 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.365 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.86 -121.27 5.64 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.59 ' HD2' ' HB2' ' A' ' 21' ' ' ALA . 41.9 tptt -169.38 -45.66 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 p -135.56 113.45 11.09 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.561 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -123.12 112.8 18.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.273 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.484 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 28.2 t-20 -92.63 107.79 19.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.941 0.401 . . . . 0.0 110.528 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.32 110.3 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.733 177.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 65.17 -80.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.808 0.693 . . . . 0.0 111.091 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -137.31 -1.93 2.43 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.237 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.425 ' N ' HD13 ' A' ' 17' ' ' ILE . 4.1 mp -104.64 115.98 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -178.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.3 m -89.38 106.25 18.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.927 0.394 . . . . 0.0 110.396 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -85.38 146.6 26.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.211 178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 75.7 mtt180 -121.25 132.46 54.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.193 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.619 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.51 112.93 1.96 Allowed 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.024 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.51 -12.03 25.76 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.058 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.7 t -116.63 119.55 62.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.649 0.261 . . . . 0.0 111.129 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 9.7 m -82.29 123.24 28.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -119.1 143.94 46.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.75 0.31 . . . . 0.0 110.642 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -70.74 131.24 43.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.421 -175.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.2 m -131.19 151.4 78.81 Favored Pre-proline 0 C--O 1.235 0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.537 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.512 ' HD2' HD13 ' A' ' 31' ' ' LEU . 16.9 Cg_exo -68.43 166.16 26.54 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.81 2.34 . . . . 0.0 111.671 175.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -62.14 -33.9 75.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.286 -175.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.96 -46.25 90.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.775 0.321 . . . . 0.0 110.63 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.512 HD13 ' HD2' ' A' ' 28' ' ' PRO . 65.3 mt -74.54 -23.22 58.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.697 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -62.63 -46.48 88.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 176.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 24.5 tp10 -76.22 -34.61 59.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.216 0.531 . . . . 0.0 110.198 177.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.425 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 49.5 t80 -58.55 -48.55 80.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.269 177.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.554 HD23 ' CE2' ' A' ' 41' ' ' PHE . 79.6 mt -79.55 -15.19 58.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.684 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.453 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 45.1 t30 -62.01 -40.56 96.1 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 173.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.5 5.32 31.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.915 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.456 ' HB2' ' HA ' ' A' ' 35' ' ' LEU . 32.0 m-80 -123.9 97.51 41.05 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.824 0.345 . . . . 0.0 110.427 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -70.77 63.93 2.39 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 123.4 2.733 . . . . 0.0 113.359 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.418 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 81.1 m-85 -120.43 -14.02 8.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.011 173.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.554 ' CE2' HD23 ' A' ' 35' ' ' LEU . 57.3 m-85 -129.21 151.42 49.9 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.211 -167.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.458 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.7 tt -97.24 118.45 43.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 166.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.6 mt -94.35 129.28 41.11 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.227 -175.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 -176.247 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.457 -0.67 0 N-CA-C 113.673 0.605 . . . . 0.0 113.673 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -174.94 35.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 122.293 1.044 . . . . 0.0 109.496 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -156.72 82.41 0.95 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.989 -172.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.414 ' N ' HD12 ' A' ' 98' ' ' ILE . 70.1 m-85 -142.37 150.06 40.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.687 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.91 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 14.0 m -60.82 138.75 58.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.562 0.22 . . . . 0.0 111.155 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.617 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.1 -37.43 77.13 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.171 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.493 ' H ' HG21 ' A' ' 58' ' ' THR . 18.6 m -70.01 -20.51 63.27 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.695 177.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.91 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 47.8 mm-40 -80.93 -45.62 16.42 Favored 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 120.227 -0.589 . . . . 0.0 109.713 173.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.46 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 87.4 mt -68.03 -18.58 64.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.842 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.617 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 1.6 mptm? -67.01 -33.46 75.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.943 0.402 . . . . 0.0 110.494 174.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.74 -22.01 27.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.049 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.441 ' HE1' ' HB3' ' A' ' 69' ' ' GLU . 96.9 mtp -73.32 136.69 44.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 110.423 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -70.65 167.36 18.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.261 -174.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 1.5 tmmt? -60.51 -41.24 93.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.9 68.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.862 176.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.441 ' HB3' ' HE1' ' A' ' 65' ' ' MET . 13.7 mm-40 -67.45 -50.01 61.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.204 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.479 ' HE1' HD11 ' A' ' 91' ' ' ILE . 85.2 m-70 -52.14 -44.5 64.59 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.698 175.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.547 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 86.4 mt-10 -60.42 -53.78 53.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.679 176.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.5 m -51.96 -44.39 63.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.972 0.415 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.1 mt -59.72 -62.52 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.711 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.463 HD12 ' HB3' ' A' ' 81' ' ' PRO . 4.4 mt -78.13 -10.4 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.627 -170.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m -80.82 -33.22 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.129 -0.357 . . . . 0.0 110.052 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -70.35 -27.11 64.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.108 0.48 . . . . 0.0 109.794 174.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.3 -23.35 65.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.968 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.41 18.61 52.22 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.579 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -40.08 6.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.659 0.229 . . . . 0.0 110.655 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 67.91 105.64 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.786 0.679 . . . . 0.0 110.832 -176.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.547 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 90.2 Cg_endo -84.2 34.17 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.805 2.337 . . . . 0.0 112.864 -177.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 p -76.41 -26.37 55.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.483 177.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.28 -31.99 62.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.435 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -82.56 108.86 16.27 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.57 -31.79 28.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.273 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.858 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 86.1 m-20 -92.27 141.69 28.29 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.276 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -60.4 -37.76 81.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.468 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.858 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 31.2 mm-40 -65.81 -35.05 79.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.465 0.65 . . . . 0.0 109.62 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -70.53 -35.4 73.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 176.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 87' ' ' ALA . 37.5 mm -61.93 -54.07 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -58.31 -40.27 81.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.869 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -67.7 -46.15 73.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.525 0.202 . . . . 0.0 111.067 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.76 -41.49 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.14 0.495 . . . . 0.0 109.885 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.475 HD12 HD11 ' A' ' 98' ' ' ILE . 4.2 mm? -67.99 -29.65 68.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.111 178.179 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.453 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 38.5 tptt -72.52 -18.43 61.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.058 0.456 . . . . 0.0 110.778 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.15 -30.28 27.97 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.475 HD11 HD12 ' A' ' 95' ' ' LEU . 39.4 mt -71.19 -35.61 58.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.0 t70 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.532 176.18 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.8 p -114.9 148.36 38.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.966 0.412 . . . . 0.0 110.618 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.54 46.83 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.133 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.783 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 1.6 ttmp? -120.16 118.75 31.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.135 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.668 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 40.0 tp -71.3 128.2 35.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.813 HG13 ' HG3' ' A' ' 8' ' ' LYS . 41.5 pt -113.74 -17.16 8.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.866 0.365 . . . . 0.0 110.986 -177.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.813 ' HG3' HG13 ' A' ' 7' ' ' ILE . 96.5 mttt -133.1 138.69 46.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -177.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.66 -13.93 24.87 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.854 178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.6 tttm 73.92 -52.89 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.532 0.733 . . . . 0.0 110.924 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.5 m -151.94 119.33 5.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.93 177.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.452 ' CE2' HG21 ' A' ' 14' ' ' VAL . 30.2 t80 -141.19 126.33 18.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.731 -178.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -92.14 125.49 36.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.912 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 ' CE2' ' A' ' 12' ' ' TYR . 47.9 t -104.81 104.94 17.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 175.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.5 mtt 65.41 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.112 -175.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.83 0.04 2.07 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.517 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.458 HD11 ' N ' ' A' ' 17' ' ' ILE . 3.7 mp -101.3 123.48 54.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 m -83.31 116.61 22.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.943 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.44 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 96.9 m-85 -106.23 140.61 38.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.745 0.307 . . . . 0.0 110.189 175.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -127.66 148.28 50.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.668 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.21 112.29 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.624 0.249 . . . . 0.0 111.167 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.08 5.28 57.36 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.387 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.6 112.37 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.997 0.427 . . . . 0.0 110.15 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.783 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 16.0 m -92.45 123.98 36.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.63 150.41 51.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.819 0.343 . . . . 0.0 111.001 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 m -79.78 138.81 37.36 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.127 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.497 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 34.7 m -134.93 158.23 75.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.723 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.465 ' HD2' HD11 ' A' ' 31' ' ' LEU . 16.6 Cg_exo -68.95 171.32 13.76 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.769 2.313 . . . . 0.0 111.577 173.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 11.4 tmtt? -66.19 -31.13 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -177.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.84 -53.81 52.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.451 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.497 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 65.3 mt -70.23 -34.69 73.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.214 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -56.18 -46.77 79.26 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -71.53 -43.15 66.98 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.895 0.379 . . . . 0.0 110.574 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -58.0 -38.52 76.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.662 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.52 HD22 ' CE1' ' A' ' 41' ' ' PHE . 78.6 mt -88.75 -9.01 53.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.047 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -76.44 -23.94 53.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 172.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -84.41 -12.95 53.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.526 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -112.41 103.27 55.34 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.659 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.55 11.44 0.48 Allowed 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.411 2.74 . . . . 0.0 114.195 -173.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -85.1 -3.72 58.9 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.575 ' CZ ' HD11 ' A' ' 6' ' ' LEU . 79.1 m-85 -118.82 131.47 56.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.11 -176.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.527 HG13 HD13 ' A' ' 7' ' ' ILE . 27.9 mt -97.45 104.12 15.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 166.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.7 mp -88.74 162.44 16.24 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.357 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.321 -0.658 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.001 -177.893 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.574 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 71.8 Cg_endo . . . . . 0 CA--C 1.53 0.279 0 CA-C-O 120.849 0.27 . . . . 0.0 112.465 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.647 HG12 HD12 ' A' ' 77' ' ' LEU . 9.6 tp -170.7 22.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.454 1.121 . . . . 0.0 109.042 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.694 HD21 HG12 ' A' ' 98' ' ' ILE . 2.6 t-20 -159.11 98.86 1.47 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.679 -173.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.574 ' OH ' ' HA ' ' A' ' 54' ' ' PRO . 95.9 m-85 -140.11 -174.66 3.99 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.51 -176.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.707 ' HB ' ' HB3' ' A' ' 61' ' ' GLU . 3.0 m -79.59 129.47 34.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.49 ' HB3' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -63.29 -39.65 95.17 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.822 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.48 ' HA ' ' HE3' ' A' ' 63' ' ' LYS . 50.2 m -64.95 -29.3 70.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.978 0.418 . . . . 0.0 109.971 174.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.707 ' HB3' ' HB ' ' A' ' 58' ' ' THR . 39.7 tt0 -76.23 -38.75 55.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.96 -27.52 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.245 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 60' ' ' SER . 48.3 mtmt -76.42 -1.24 26.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.26 26.46 8.2 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 172.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.485 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 24.1 mmt -119.33 161.71 20.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.554 -0.323 . . . . 0.0 110.444 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.481 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 16.2 m-80 -91.62 -167.81 1.88 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.472 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -79.46 -35.22 40.69 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.229 -177.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.12 77.23 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.409 0.443 . . . . 0.0 112.017 -171.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' HG3' ' HB3' ' A' ' 65' ' ' MET . 2.6 pm0 -63.03 -47.0 84.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.775 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.499 ' HE1' HG12 ' A' ' 91' ' ' ILE . 19.7 m-70 -55.31 -41.37 72.28 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.565 0.222 . . . . 0.0 111.079 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.463 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.6 mt-10 -65.73 -50.15 65.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.986 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 m -58.59 -38.11 77.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 69' ' ' GLU . 69.1 mt -54.61 -61.97 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.407 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.492 HD11 ' HB3' ' A' ' 81' ' ' PRO . 2.0 mt -79.3 -21.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.983 -170.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.5 p -71.19 -25.5 62.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.541 -0.464 . . . . 0.0 109.779 175.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -76.25 -33.35 59.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.107 172.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.647 HD12 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -62.47 -38.89 91.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.117 0.484 . . . . 0.0 110.708 174.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.32 -46.99 1.04 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.233 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.511 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 48.8 ttt85 -77.37 111.7 13.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.134 0.492 . . . . 0.0 109.768 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -62.32 130.66 93.33 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.085 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.492 ' HB3' HD11 ' A' ' 74' ' ' ILE . 91.9 Cg_endo -86.53 24.92 0.71 Allowed 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 123.254 2.636 . . . . 0.0 112.718 -177.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.2 m -73.65 -36.81 65.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.921 0.391 . . . . 0.0 110.344 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -73.59 -27.42 61.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.535 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.52 108.88 16.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.293 177.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -99.37 -54.61 2.91 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.05 -171.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -83.15 158.47 22.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.903 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.11 73.23 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.173 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -50.44 -49.23 55.57 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.637 0.586 . . . . 0.0 110.882 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.18 -49.39 74.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.981 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.7 mtt180 -64.2 -43.52 94.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.085 -176.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.499 HG12 ' HE1' ' A' ' 70' ' ' HIS . 91.1 mt -71.3 -43.88 73.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.178 -176.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.485 ' HA ' HD11 ' A' ' 95' ' ' LEU . . . -58.81 -40.21 83.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 111.174 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.511 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 41.9 t80 -68.1 -42.57 80.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.47 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.498 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.9 mt -60.92 -39.71 82.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.524 ' HA ' HD13 ' A' ' 98' ' ' ILE . 38.3 mt -55.55 -40.73 72.26 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.025 177.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 92' ' ' ALA . 66.0 mttm -60.33 -34.27 73.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.391 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -83.55 -18.99 36.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.014 0.435 . . . . 0.0 110.621 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.694 HG12 HD21 ' A' ' 56' ' ' ASN . 78.1 mt -70.07 -41.79 79.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.912 176.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.559 176.797 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 120.727 0.299 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 p -127.42 139.55 52.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.431 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.17 128.2 54.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -111.32 105.5 14.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.018 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 50.6 tp -65.72 116.89 7.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.528 HD11 HG13 ' A' ' 42' ' ' ILE . 42.5 pt -107.1 -29.87 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.811 0.339 . . . . 0.0 111.58 -175.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 50.4 mttm -106.5 128.91 54.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.322 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.24 -128.51 8.57 Favored Glycine 0 N--CA 1.441 -0.981 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.126 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -170.12 -46.94 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -175.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.26 113.49 6.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.685 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -123.1 104.21 9.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.338 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.515 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 23.8 t-20 -90.23 122.2 32.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.848 0.356 . . . . 0.0 111.034 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.8 t -119.99 111.78 34.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.763 174.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.1 mtt 64.52 -95.29 0.04 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.884 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.94 17.42 6.33 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.056 -0.593 . . . . 0.0 111.712 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.449 HD12 HD13 ' A' ' 31' ' ' LEU . 4.6 mp -123.42 110.87 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 30.5 m -90.53 107.34 19.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.631 177.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.428 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 91.9 m-85 -84.91 151.02 24.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 179.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 46.6 mtm180 -133.83 145.68 49.93 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.562 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -54.61 114.82 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.993 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.84 -7.16 67.54 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.626 177.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.6 t -100.82 125.43 54.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.873 0.368 . . . . 0.0 111.275 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 m -94.59 121.73 36.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.122 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -124.57 146.06 49.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.601 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.8 m -75.13 126.71 31.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.6 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.9 m -122.75 154.33 63.65 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-O 120.678 0.275 . . . . 0.0 111.45 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.517 ' HD2' HD12 ' A' ' 31' ' ' LEU . 21.2 Cg_exo -66.86 164.23 30.4 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.8 2.334 . . . . 0.0 111.015 172.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -64.19 -32.58 74.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.001 -175.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -54.57 -52.02 63.44 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.995 0.426 . . . . 0.0 110.489 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.517 HD12 ' HD2' ' A' ' 28' ' ' PRO . 49.3 mt -67.92 -33.63 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.472 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.561 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 87.4 t80 -59.13 -44.13 92.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.879 0.371 . . . . 0.0 110.305 178.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -77.7 -40.17 42.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -59.76 -40.43 88.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.329 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -87.67 -13.48 42.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 8.1 t30 -63.83 -36.9 85.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.16 8.18 16.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.468 176.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 31.5 m-80 -127.99 91.93 43.46 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.118 0.485 . . . . 0.0 110.157 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -75.14 57.0 4.51 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.745 2.963 . . . . 0.0 114.643 -169.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 3.3 p90 -133.58 22.36 3.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.649 0.738 . . . . 0.0 110.121 170.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.427 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.79 148.93 50.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.766 175.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 7' ' ' ILE . 50.3 mt -97.03 110.09 24.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 163.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.561 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 68.6 mt -91.84 133.1 35.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.367 -175.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.419 -177.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.425 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 11.9 Cg_exo . . . . . 0 CA--C 1.528 0.219 0 N-CA-C 113.033 0.359 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.814 HG12 HD11 ' A' ' 77' ' ' LEU . 9.5 tp -179.47 26.67 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 122.047 0.927 . . . . 0.0 109.716 175.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.519 ' HB3' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -163.78 98.09 0.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.654 -174.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -142.3 160.13 40.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.502 -177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 1.7 m -57.16 137.3 56.04 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.467 0.479 . . . . 0.0 110.175 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.431 ' HB3' HD12 ' A' ' 95' ' ' LEU . 0.6 OUTLIER -62.81 -31.17 72.11 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.369 -0.532 . . . . 0.0 109.865 176.8 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.2 t -64.87 -41.38 95.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.599 172.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -68.35 -42.17 79.65 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.35 179.525 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.454 HD21 ' SD ' ' A' ' 65' ' ' MET . 99.9 mt -66.39 -32.62 74.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.41 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HG3' HD13 ' A' ' 91' ' ' ILE . 43.1 mtmt -76.71 -16.96 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.055 0.455 . . . . 0.0 110.538 175.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.05 23.27 36.63 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.631 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.1 mtt -117.67 160.71 20.85 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.271 0.558 . . . . 0.0 111.042 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.547 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 38.6 t30 -74.02 152.54 39.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.055 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 49.4 mtmt -52.45 -47.07 66.64 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.337 177.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.3 64.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.776 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.547 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 26.8 mm-40 -66.21 -44.45 83.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.575 ' O ' HG13 ' A' ' 74' ' ' ILE . 76.3 m-70 -57.64 -42.84 84.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.09 0.472 . . . . 0.0 110.247 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.5 -46.25 86.96 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.65 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.8 p -72.57 -36.18 68.14 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.643 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 69' ' ' GLU . 81.7 mt -56.6 -55.86 17.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.18 0.514 . . . . 0.0 110.716 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.4 mt -77.14 -18.58 14.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.019 0.438 . . . . 0.0 110.537 -175.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.1 t -64.65 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.11 -34.97 79.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.297 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.814 HD11 HG12 ' A' ' 55' ' ' ILE . 58.2 tp -59.06 -34.89 72.48 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.183 0.515 . . . . 0.0 110.545 174.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.22 14.73 11.4 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.036 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.417 ' HD3' ' OH ' ' A' ' 93' ' ' TYR . 48.9 ttt180 -145.78 92.76 2.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.147 0.498 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.573 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 51.0 t30 -58.67 132.48 85.99 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.676 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.573 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 85.2 Cg_exo -44.95 84.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.987 3.125 . . . . 0.0 113.575 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.3 t -78.83 108.63 12.41 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.925 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.5 t70 51.68 62.05 2.9 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.978 0.799 . . . . 0.0 111.731 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -116.97 108.09 15.36 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 171.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -99.6 -32.4 11.11 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.065 0.46 . . . . 0.0 110.246 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -72.1 124.33 24.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.98 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.43 88.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.888 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.56 -25.87 67.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.288 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -67.38 -42.68 82.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.685 0.279 . . . . 0.0 110.551 -177.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 mtt-85 -62.07 -43.59 98.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.372 0.606 . . . . 0.0 109.779 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.411 HD13 ' HG3' ' A' ' 63' ' ' LYS . 45.1 mt -67.63 -42.51 86.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.229 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.35 78.17 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.271 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.417 ' OH ' ' HD3' ' A' ' 79' ' ' ARG . 30.1 t80 -68.91 -38.84 79.83 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.206 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.438 ' O ' HG13 ' A' ' 98' ' ' ILE . 73.6 mt -65.82 -47.16 86.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.02 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 59' ' ' GLU . 95.1 mt -62.09 -38.36 88.58 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.082 0.468 . . . . 0.0 111.013 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -61.85 -36.5 81.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.426 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -22.51 60.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.519 HG12 ' HB3' ' A' ' 56' ' ' ASN . 53.6 mt -73.57 -40.31 54.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 109.686 175.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.5 t70 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.156 179.724 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.415 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 61.3 m-85 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.4 t -126.37 147.39 49.77 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.63 135.23 54.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.933 0.397 . . . . 0.0 110.918 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.482 ' HB2' ' HG ' ' A' ' 24' ' ' SER . 86.1 tttt -119.4 118.35 30.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.462 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.766 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.66 130.42 43.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.52 HD11 HG13 ' A' ' 42' ' ' ILE . 40.4 pt -120.14 -0.52 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.835 0.35 . . . . 0.0 111.408 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -135.71 121.54 19.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.79 -174.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 100.43 -125.05 8.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.45 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.489 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 38.6 ttmt -155.37 -52.08 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.5 m -144.29 126.48 15.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.907 0.384 . . . . 0.0 111.168 -178.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -142.5 131.04 22.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.033 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 65.1 t30 -93.92 120.54 34.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.113 0.482 . . . . 0.0 111.166 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 90.7 t -99.89 95.17 3.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.914 176.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.3 mtt 62.8 -81.02 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.826 -176.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.17 -2.13 5.59 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.96 177.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -103.57 105.62 18.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -178.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 4.1 m -86.2 117.69 25.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.878 0.371 . . . . 0.0 110.545 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 25' ' ' GLN . 96.1 m-85 -103.88 152.95 21.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 36.5 mtm180 -124.09 139.77 53.61 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.821 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.766 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -51.13 118.63 3.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.108 0.48 . . . . 0.0 111.24 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.89 -22.46 35.23 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.3 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -93.16 122.4 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 110.698 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.482 ' HG ' ' HB2' ' A' ' 5' ' ' LYS . 15.9 m -95.19 125.55 39.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.746 175.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HB2' ' CE1' ' A' ' 19' ' ' PHE . 25.9 mt-30 -130.87 140.72 50.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.061 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.0 p -67.7 133.25 48.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.741 -175.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -121.96 149.63 54.29 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.327 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.515 ' HD2' HD12 ' A' ' 31' ' ' LEU . 22.5 Cg_exo -65.74 163.12 31.72 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.766 2.311 . . . . 0.0 110.774 171.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -63.27 -29.04 70.44 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.433 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.75 -53.69 50.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.437 175.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.515 HD12 ' HD2' ' A' ' 28' ' ' PRO . 67.2 mt -67.98 -25.55 65.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.038 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.415 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 81.2 t80 -59.68 -47.26 86.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 176.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -73.21 -38.75 65.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.807 0.337 . . . . 0.0 110.628 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -58.29 -47.64 83.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.914 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.527 ' HB2' HD22 ' A' ' 43' ' ' LEU . 89.2 mt -80.63 -22.21 40.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.035 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.29 -28.79 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.512 0.673 . . . . 0.0 109.729 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -81.39 0.05 39.19 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.59 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -121.76 116.61 30.28 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.205 0.526 . . . . 0.0 111.258 -176.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.59 10.37 2.25 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 123.169 2.579 . . . . 0.0 114.605 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -107.02 12.09 29.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.438 0.637 . . . . 0.0 110.482 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -127.35 127.58 44.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.325 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.52 HG13 HD11 ' A' ' 7' ' ' ILE . 50.4 mt -97.52 109.96 24.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.527 HD22 ' HB2' ' A' ' 35' ' ' LEU . 5.2 mp -94.83 149.78 20.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.822 -178.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.7 m . . . . . 0 C--N 1.317 -0.821 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 -177.828 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo . . . . . 0 N--CA 1.451 -1.023 0 N-CA-C 111.967 -0.051 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.67 HG12 HD23 ' A' ' 77' ' ' LEU . 10.7 tp 38.78 61.2 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.863 0.865 . . . . 0.0 112.951 173.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -174.43 87.52 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.586 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -142.86 161.94 36.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.736 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.644 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 2.0 m -74.19 143.74 45.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.627 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -34.69 78.77 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.357 0.599 . . . . 0.0 109.959 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.6 m -75.83 -25.95 56.74 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.582 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.711 ' HG2' ' HE3' ' A' ' 65' ' ' MET . 56.2 tt0 -77.19 -44.81 28.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.405 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.685 ' HB3' ' HE1' ' A' ' 70' ' ' HIS . 89.9 mt -65.2 -33.6 76.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.585 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -72.45 -12.75 61.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.843 176.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.56 28.48 13.26 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 176.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.711 ' HE3' ' HG2' ' A' ' 61' ' ' GLU . 58.2 mtt -119.67 -171.24 2.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 111.078 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.485 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 4.9 t30 -114.7 162.92 16.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.668 176.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 18.9 ptmt -56.05 -40.24 73.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.476 ' H ' ' ND2' ' A' ' 66' ' ' ASN . . . -56.72 -49.68 74.44 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -170.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.539 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 pm0 -59.39 -46.88 87.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.077 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.685 ' HE1' ' HB3' ' A' ' 62' ' ' LEU . 89.0 m-70 -50.38 -50.7 50.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.972 0.415 . . . . 0.0 110.922 177.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.538 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 4.0 mm-40 -61.88 -43.66 98.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.704 -176.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -63.03 -44.4 96.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.742 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.8 mt -52.63 -58.33 2.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.919 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.473 HD11 ' HB3' ' A' ' 81' ' ' PRO . 0.8 OUTLIER -75.48 -21.88 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.043 -172.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.9 m -70.63 -23.95 62.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.848 0.356 . . . . 0.0 110.699 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.96 -30.11 28.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.101 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.67 HD23 HG12 ' A' ' 55' ' ' ILE . 51.2 tp -67.75 -37.97 82.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.848 174.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 133.94 -60.82 0.65 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.016 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.4 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 62.1 ttt180 -65.92 108.1 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.412 HD21 ' HA ' ' A' ' 80' ' ' ASN . 11.2 m120 -63.74 142.36 98.04 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.649 -175.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.538 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 55.2 Cg_endo -67.13 -7.6 19.31 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 123.569 2.846 . . . . 0.0 112.51 -176.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.7 m -64.25 -17.58 63.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.77 179.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -76.2 -20.34 57.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.257 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -111.11 112.72 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.016 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.75 -36.04 32.51 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -173.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.405 ' HB3' ' OD1' ' A' ' 88' ' ' ASP . 66.8 t30 -107.01 164.22 12.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.74 0.305 . . . . 0.0 110.642 -176.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 90' ' ' ARG . . . -64.89 -34.12 77.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.847 -177.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 86' ' ' ASN . 22.8 p-10 -64.24 -47.4 79.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.207 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -60.25 -38.25 82.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.911 0.386 . . . . 0.0 110.843 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.3 mtt85 -58.78 -52.22 66.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.431 175.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.77 -44.54 96.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.258 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.24 -41.32 75.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.432 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.4 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 27.2 t80 -72.58 -34.86 67.74 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.998 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.8 mt -67.77 -41.87 85.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.458 HD11 HD12 ' A' ' 98' ' ' ILE . 4.4 mm? -65.71 -38.53 89.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.766 176.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -57.33 -37.71 72.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.929 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -7.77 59.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.948 -175.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.458 HD12 HD11 ' A' ' 95' ' ' LEU . 27.9 mt -72.91 -44.82 57.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 173.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.571 -179.591 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.9 p -122.9 136.35 54.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.771 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.4 117.72 29.25 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.657 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.453 ' HB2' ' HA ' ' A' ' 24' ' ' SER . 34.9 ttpt -106.63 121.22 43.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.062 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.812 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 26.0 tp -66.42 116.08 7.04 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.549 HG13 ' HG3' ' A' ' 8' ' ' LYS . 31.9 pt -106.15 -13.08 9.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 120.96 0.41 . . . . 0.0 111.586 -174.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HG3' HG13 ' A' ' 7' ' ' ILE . 95.2 mttt -130.36 109.88 11.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.183 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.6 -120.49 2.56 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.229 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -171.72 -66.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 m -135.05 113.05 11.06 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.438 ' CE2' HG21 ' A' ' 14' ' ' VAL . 26.1 t80 -133.08 130.55 39.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.95 0.405 . . . . 0.0 111.056 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -97.65 125.53 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.831 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.482 HG11 HD22 ' A' ' 35' ' ' LEU . 44.4 t -112.58 115.89 51.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.415 ' SD ' HD21 ' A' ' 31' ' ' LEU . 61.4 mtt 67.88 -73.85 0.08 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.478 0.711 . . . . 0.0 111.076 -177.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 19.75 0.28 Allowed Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.475 HD11 HD12 ' A' ' 31' ' ' LEU . 3.9 mp -118.15 137.34 52.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.0 m -95.08 118.0 31.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 111.548 -176.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -106.16 140.11 39.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.028 177.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -122.82 142.46 50.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.096 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.812 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -65.54 106.13 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.003 0.43 . . . . 0.0 110.725 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 109.6 -5.38 31.19 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.204 -178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.0 t -113.61 122.11 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.838 0.351 . . . . 0.0 110.705 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 12.4 m -82.13 100.59 9.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.216 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -86.72 142.26 28.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.624 -176.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.5 m -81.1 125.43 30.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.65 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 33.0 m -130.49 155.82 80.53 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.253 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -74.27 162.22 38.96 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.53 2.153 . . . . 0.0 110.539 170.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 83.1 tttt -60.55 -23.81 64.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.61 0.243 . . . . 0.0 110.824 -178.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -56.6 -52.08 66.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.083 0.468 . . . . 0.0 109.893 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 59.2 mt -75.78 -29.06 58.63 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.768 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 89.8 t80 -57.47 -43.26 83.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.006 0.432 . . . . 0.0 110.513 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -80.09 -40.01 28.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.27 0.557 . . . . 0.0 110.305 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.19 -35.1 76.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.958 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.482 HD22 HG11 ' A' ' 14' ' ' VAL . 90.3 mt -92.68 -15.72 26.39 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.259 -0.276 . . . . 0.0 110.901 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.43 -37.38 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.0 109.817 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.73 6.61 10.38 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.67 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -116.15 113.78 41.34 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.046 0.451 . . . . 0.0 110.424 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.92 23.74 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 123.206 2.604 . . . . 0.0 114.517 -171.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 6.8 p90 -122.25 16.69 10.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.498 0.666 . . . . 0.0 110.392 175.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.505 ' CZ ' HD11 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.49 135.5 49.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.779 173.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.441 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.7 tt -98.81 128.37 50.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.97 118.17 32.67 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.166 -0.613 . . . . 0.0 111.371 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.967 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.488 ' O ' HG21 ' A' ' 55' ' ' ILE . 17.2 Cg_endo . . . . . 0 CA--C 1.529 0.25 0 N-CA-C 113.436 0.514 . . . . 0.0 113.436 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.488 HG21 ' O ' ' A' ' 54' ' ' PRO . 7.6 tp 52.29 26.84 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.389 1.075 . . . . 0.0 111.951 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -147.62 80.75 1.5 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.448 0.642 . . . . 0.0 109.68 -175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -138.23 159.36 42.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.712 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.59 148.38 35.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.631 174.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 35.5 tt0 -57.43 -42.76 83.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 176.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m -59.85 -32.67 70.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.189 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.66 -37.27 59.75 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.102 0.477 . . . . 0.0 110.393 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.462 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 85.8 mt -81.25 -18.99 44.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.957 -177.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 31.2 mmtp -65.15 -29.81 70.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.973 0.416 . . . . 0.0 110.996 177.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.09 2.52 79.27 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.358 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.423 ' SD ' HD22 ' A' ' 62' ' ' LEU . 65.8 mtt -103.19 137.78 40.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.778 0.323 . . . . 0.0 110.222 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.462 ' O ' ' HD2' ' A' ' 70' ' ' HIS . 39.0 m-80 -74.78 171.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.776 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -58.2 -36.97 73.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.073 -178.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.88 91.33 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.541 0.526 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.524 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 mp0 -57.41 -47.13 82.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.901 0.382 . . . . 0.0 110.382 177.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.585 ' O ' HG13 ' A' ' 74' ' ' ILE . 36.1 m-70 -58.22 -41.63 84.52 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 177.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.568 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 43.4 mt-10 -59.57 -49.75 76.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.239 -178.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 p -63.99 -34.29 77.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.664 0.269 . . . . 0.0 111.259 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.7 mt -61.39 -54.88 29.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.16 0.505 . . . . 0.0 111.006 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.7 mt -75.34 -21.53 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.799 -174.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 73.9 m -64.57 -37.3 87.07 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.23 -34.26 75.91 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.179 175.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.454 HD12 HG22 ' A' ' 55' ' ' ILE . 42.8 tp -64.81 -37.63 88.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.775 175.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.36 23.16 5.84 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.728 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.495 ' HB3' HG23 ' A' ' 74' ' ' ILE . 3.9 tpt180 -125.31 131.65 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -66.02 116.12 29.74 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 121.513 0.673 . . . . 0.0 110.331 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -83.38 -5.33 11.01 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.827 2.352 . . . . 0.0 113.167 -175.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.5 t -77.57 -0.13 25.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.404 178.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -77.81 -15.89 58.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.413 0.625 . . . . 0.0 109.713 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -102.52 128.04 49.32 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.002 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -84.83 -26.02 27.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.905 0.383 . . . . 0.0 111.09 -173.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.512 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 30.4 p30 -126.01 169.75 12.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.332 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.29 -18.24 59.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.589 0.233 . . . . 0.0 111.271 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.09 -49.27 68.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.894 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -62.94 -32.62 73.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.823 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 46.4 mtt-85 -65.35 -40.02 93.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.987 178.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.0 mt -62.83 -47.44 92.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.199 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.92 -39.72 78.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.621 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.98 -45.39 77.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.791 0.329 . . . . 0.0 110.39 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.9 mt -66.21 -39.13 83.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.505 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.77 -30.05 70.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.833 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -80.56 -34.73 35.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.257 0.551 . . . . 0.0 110.32 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.66 -30.57 56.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.408 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 10.5 tt -69.44 -23.98 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 121.173 0.511 . . . . 0.0 109.794 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.4 t70 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.288 175.387 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.582 0.23 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.478 ' HB ' ' HB2' ' A' ' 24' ' ' SER . 26.0 p -129.6 142.78 50.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.842 0.353 . . . . 0.0 111.288 177.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 24' ' ' SER . . . -118.52 140.93 49.11 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 36.3 ttpt -122.07 123.29 41.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.146 0.498 . . . . 0.0 111.412 -175.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 3.4 tm? -73.86 125.28 27.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.182 176.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.516 HD13 HG13 ' A' ' 42' ' ' ILE . 43.4 pt -112.12 -15.06 10.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.601 -178.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.438 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 83.2 tttt -140.99 113.66 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.632 0.253 . . . . 0.0 110.811 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.68 -5.69 5.5 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.232 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.565 ' HZ1' ' HB2' ' A' ' 10' ' ' LYS . 4.7 ttmp? 73.6 -53.75 0.69 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.086 0.554 . . . . 0.0 110.784 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.447 HG21 ' HG2' ' A' ' 20' ' ' ARG . 1.4 p -147.02 142.2 27.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.378 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -152.91 140.34 19.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -107.76 129.36 55.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.936 -177.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -126.84 101.2 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.373 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' MET . . . . . 0.504 ' SD ' HD23 ' A' ' 31' ' ' LEU . 65.9 mtt 56.05 32.98 21.03 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.666 176.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.35 -24.76 26.76 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.324 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.09 118.6 21.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 20.5 m -100.05 105.45 17.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.178 0.513 . . . . 0.0 111.053 -176.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.49 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 95.2 m-85 -92.44 153.25 19.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.016 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HG2' HG21 ' A' ' 11' ' ' THR . 83.3 mtt85 -133.57 153.91 51.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.412 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.463 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.51 111.06 0.8 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.994 0.426 . . . . 0.0 111.218 176.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.8 6.37 67.52 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.636 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 87.9 t -114.55 110.32 31.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.04 0.448 . . . . 0.0 111.139 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.51 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 24.8 p -86.7 114.94 23.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.686 174.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -110.51 159.27 17.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.4 p -67.45 135.23 52.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.949 0.404 . . . . 0.0 112.022 -175.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.44 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 31.4 m -129.76 144.08 51.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.188 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.518 ' HD2' HD11 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -66.21 167.89 17.23 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 123.24 2.626 . . . . 0.0 112.211 174.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -55.66 -40.28 72.05 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.421 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -75.57 -34.15 60.66 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.227 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.518 HD11 ' HD2' ' A' ' 28' ' ' PRO . 34.9 mt -75.99 -25.6 55.94 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.036 -179.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.48 -42.88 97.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.962 0.41 . . . . 0.0 110.087 176.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.96 -38.06 46.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.53 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -57.5 -43.5 84.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.467 ' HB2' HD23 ' A' ' 43' ' ' LEU . 92.3 mt -84.72 -20.22 31.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.982 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -62.3 -36.6 82.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.357 0.598 . . . . 0.0 109.978 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 24.85 3.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.43 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -116.8 121.77 32.41 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.847 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.62 -32.63 93.56 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.274 2.649 . . . . 0.0 114.238 -174.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.438 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 6.1 p90 -99.24 23.27 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -131.16 120.34 23.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 111.453 175.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.516 HG13 HD13 ' A' ' 7' ' ' ILE . 71.4 mt -106.21 111.43 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.467 HD23 ' HB2' ' A' ' 35' ' ' LEU . 5.4 mp -91.8 169.14 10.94 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.8 m . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.89 178.432 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.53 ' O ' HG23 ' A' ' 73' ' ' ILE . 7.0 Cg_exo . . . . . 0 N--CA 1.46 -0.447 0 CA-C-O 120.364 0.068 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.561 HD12 HG22 ' A' ' 94' ' ' ILE . 11.0 tp 178.32 26.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 121.951 0.881 . . . . 0.0 109.763 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.467 ' HA ' HD12 ' A' ' 98' ' ' ILE . 25.2 p-10 -142.48 38.22 1.52 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.567 -170.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.616 ' HB2' HD23 ' A' ' 62' ' ' LEU . 75.2 m-85 -96.64 165.64 12.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.945 0.402 . . . . 0.0 111.482 -175.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.517 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 14.3 m -64.37 138.17 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.194 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -51.28 -54.1 29.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.12 0.485 . . . . 0.0 109.774 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.4 t -59.34 -34.43 72.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.731 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.643 ' HG2' ' HE1' ' A' ' 65' ' ' MET . 34.6 tt0 -71.79 -42.13 67.48 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.055 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.616 HD23 ' HB2' ' A' ' 57' ' ' TYR . 80.8 mt -65.37 -40.9 94.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.325 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.628 ' HG3' HG12 ' A' ' 91' ' ' ILE . 98.7 mttt -68.22 -17.17 64.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.033 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.54 11.14 42.64 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.237 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.643 ' HE1' ' HG2' ' A' ' 61' ' ' GLU . 45.9 mtt -89.13 162.19 16.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.0 111.528 -179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.706 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 45.6 t-20 -71.2 145.98 49.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.202 174.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 14.2 tmtt? -53.69 -39.35 65.08 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.603 177.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.99 -28.03 67.93 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.742 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.706 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 23.1 mm-40 -64.35 -50.16 68.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.699 ' O ' HG12 ' A' ' 74' ' ' ILE . 64.8 m-70 -55.45 -42.49 74.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.916 176.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 45.6 mt-10 -58.51 -51.56 69.34 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.388 0.43 . . . . 0.0 110.352 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m -55.03 -42.11 72.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.509 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.53 HG23 ' O ' ' A' ' 54' ' ' PRO . 88.2 mt -57.7 -60.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.509 178.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.699 HG12 ' O ' ' A' ' 70' ' ' HIS . 3.1 pt -76.24 -13.92 14.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -174.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.7 m -72.59 -45.22 60.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -74.39 -30.2 61.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.467 HD23 HD11 ' A' ' 55' ' ' ILE . 33.4 tp -67.63 -34.2 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.41 36.06 3.67 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.17 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.565 ' HB3' ' HB ' ' A' ' 74' ' ' ILE . 30.7 tpt180 -115.55 -50.92 2.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.573 0.225 . . . . 0.0 110.523 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.6 t30 68.08 134.12 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.452 0 O-C-N 124.028 0.83 . . . . 0.0 111.16 -177.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.52 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 20.4 Cg_endo -81.05 61.98 8.39 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.457 2.105 . . . . 0.0 112.506 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.7 p -86.42 -17.81 33.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.549 -179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -149.77 81.76 1.39 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 110.607 175.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.425 ' CD2' ' HA ' ' A' ' 81' ' ' PRO . 85.3 m-85 -142.27 108.57 5.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.15 174.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -102.67 -28.07 12.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.084 -175.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.569 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 84.0 m-20 -107.11 152.69 23.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.757 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.58 -37.65 73.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -55.16 -41.49 71.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.707 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.569 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 48.2 mm-40 -59.88 -45.42 92.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.171 177.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -62.53 -46.79 86.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.628 HG12 ' HG3' ' A' ' 63' ' ' LYS . 1.9 mp -66.52 -40.38 86.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.421 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.15 -40.53 90.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.493 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -71.04 -37.3 72.55 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.851 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.561 HG22 HD12 ' A' ' 55' ' ' ILE . 64.1 mt -70.72 -37.95 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.552 179.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.431 HD11 HD11 ' A' ' 98' ' ' ILE . 3.9 mm? -71.98 -18.71 61.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.133 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -60.9 -43.73 98.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -69.95 -37.35 75.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.661 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.467 HD12 ' HA ' ' A' ' 56' ' ' ASN . 64.2 mt -64.34 -41.61 92.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.56 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.606 176.934 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 26' ' ' THR . 56.0 m-85 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 25' ' ' GLN . 14.3 p -113.59 123.08 49.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.956 0.408 . . . . 0.0 110.823 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.98 135.06 49.19 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.136 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 28.7 ttpp -126.53 122.78 36.11 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.42 -178.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -63.95 117.4 6.96 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.735 HG13 ' HG3' ' A' ' 8' ' ' LYS . 33.7 pt -106.12 -27.21 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.593 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.735 ' HG3' HG13 ' A' ' 7' ' ' ILE . 29.9 mtpp -117.36 100.58 7.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.334 -177.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.8 -120.92 1.82 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.567 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.483 ' HG3' ' H ' ' A' ' 11' ' ' THR . 20.8 pttp -176.21 -56.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -174.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.483 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.5 p -142.21 119.22 11.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.206 -178.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -154.51 124.2 6.61 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.55 135.92 49.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.998 0.428 . . . . 0.0 110.631 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.406 HG23 HD23 ' A' ' 35' ' ' LEU . 58.5 t -107.3 107.03 21.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.944 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.9 mtt 65.66 -75.25 0.05 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.972 0.795 . . . . 0.0 111.334 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -138.76 -3.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.82 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.455 HD11 ' N ' ' A' ' 17' ' ' ILE . 4.1 mp -101.15 115.32 42.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -91.05 112.14 23.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.155 -174.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.44 153.81 19.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.269 0.556 . . . . 0.0 111.322 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -131.79 150.98 51.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.427 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -57.91 111.65 1.23 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.769 0.319 . . . . 0.0 110.841 175.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.76 -8.66 43.35 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.543 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -104.3 119.39 53.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.809 0.338 . . . . 0.0 110.654 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 20.4 p -102.72 123.08 45.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.204 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 3' ' ' THR . 48.9 mt-30 -127.65 157.78 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.655 0.265 . . . . 0.0 111.134 -178.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 0.8 OUTLIER -71.83 128.81 36.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.605 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 34.1 m -123.95 145.84 49.14 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.684 178.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.526 ' HD2' HD13 ' A' ' 31' ' ' LEU . 26.0 Cg_exo -63.5 156.89 53.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.711 2.274 . . . . 0.0 111.356 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -53.94 -36.07 62.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.53 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.45 -44.68 95.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.526 HD13 ' HD2' ' A' ' 28' ' ' PRO . 76.4 mt -78.26 -26.81 47.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.764 0.316 . . . . 0.0 110.613 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -57.63 -48.33 79.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.391 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -77.1 -30.76 55.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.041 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -61.31 -46.15 91.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.107 176.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.406 HD23 HG23 ' A' ' 14' ' ' VAL . 82.8 mt -77.97 -19.55 54.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.247 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -65.53 -28.08 68.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.31 0.576 . . . . 0.0 110.079 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -90.64 10.64 24.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.951 176.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -135.02 97.44 13.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.359 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -71.81 28.07 0.24 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.788 2.992 . . . . 0.0 114.904 -169.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.445 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.7 p90 -112.37 9.65 19.81 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.484 -0.487 . . . . 0.0 111.044 175.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.409 ' CZ ' HD22 ' A' ' 6' ' ' LEU . 42.9 m-85 -123.64 140.99 52.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.342 171.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.452 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.8 tt -97.18 126.66 49.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 171.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.01 103.98 13.63 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.623 -174.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.9 m . . . . . 0 C--N 1.318 -0.8 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.417 -177.397 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.479 ' O ' HG23 ' A' ' 55' ' ' ILE . 98.3 Cg_endo . . . . . 0 N--CA 1.46 -0.485 0 N-CA-C 113.121 0.393 . . . . 0.0 113.121 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.493 HD12 ' HG3' ' A' ' 97' ' ' GLN . 7.2 tp 52.61 25.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.433 1.093 . . . . 0.0 111.738 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -157.02 92.66 1.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.988 -175.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -142.77 159.95 41.26 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.485 HG21 ' H ' ' A' ' 60' ' ' SER . 3.2 m -67.98 145.03 54.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.055 174.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.404 ' HB2' HD11 ' A' ' 95' ' ' LEU . 2.4 tm-20 -56.54 -31.64 64.34 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 171.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.485 ' H ' HG21 ' A' ' 58' ' ' THR . 14.9 m -60.05 -38.75 83.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.456 172.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.26 -36.25 24.69 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.21 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.0 mt -72.76 -16.86 61.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.41 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.571 ' HD2' HD13 ' A' ' 91' ' ' ILE . 0.6 OUTLIER -63.45 -36.03 82.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.453 176.663 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.43 -135.23 5.2 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.068 -176.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm 61.77 -166.88 0.21 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 122.896 0.478 . . . . 0.0 110.124 -173.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -106.26 162.2 13.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.454 ' HE2' ' HB2' ' A' ' 67' ' ' LYS . 3.5 mppt? -69.63 -33.44 72.63 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 121.343 -0.143 . . . . 0.0 110.73 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.37 -46.04 46.63 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.793 0.683 . . . . 0.0 112.394 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.6 mp0 -57.63 -55.99 27.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 110.068 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.532 ' HA ' HD13 ' A' ' 73' ' ' ILE . 69.3 m-70 -55.58 -47.75 75.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.998 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.49 -50.97 70.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.424 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.4 m -56.93 -37.83 72.03 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.316 0.579 . . . . 0.0 110.825 -178.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.532 HD13 ' HA ' ' A' ' 70' ' ' HIS . 88.0 mt -60.8 -60.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.544 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.479 ' HB ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -70.18 -29.04 38.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.113 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.491 ' HA ' ' OD1' ' A' ' 80' ' ' ASN . 13.6 p -67.17 -32.78 74.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.839 0.352 . . . . 0.0 110.659 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -87.46 -18.05 30.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.878 0.37 . . . . 0.0 110.942 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.8 -37.75 67.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.045 175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 126.25 -13.71 7.02 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.208 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.479 ' O ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -113.93 80.35 1.37 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.206 0.527 . . . . 0.0 110.244 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.491 ' OD1' ' HA ' ' A' ' 75' ' ' SER . 77.2 m-20 -52.64 139.72 39.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.101 178.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.485 ' HA ' ' HB2' ' A' ' 84' ' ' PHE . 61.1 Cg_endo -75.3 51.19 2.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.976 2.451 . . . . 0.0 113.006 -178.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.6 m -71.13 -51.06 27.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.874 0.369 . . . . 0.0 110.504 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -100.37 -6.22 26.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.122 0.486 . . . . 0.0 110.429 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.485 ' HB2' ' HA ' ' A' ' 81' ' ' PRO . 97.2 m-85 -90.79 108.66 19.97 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -145.2 -39.21 0.25 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.137 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.75 139.96 57.84 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.562 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 90' ' ' ARG . . . -52.55 -52.89 52.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -74.63 -25.5 59.27 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.691 -174.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.84 -39.84 76.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.438 0.637 . . . . 0.0 109.978 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 87' ' ' ALA . 12.1 ttm180 -54.48 -54.2 44.07 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.417 174.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.571 HD13 ' HD2' ' A' ' 63' ' ' LYS . 47.4 mt -61.67 -42.66 95.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.685 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.11 74.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.867 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -65.45 -48.17 73.62 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.865 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.27 -34.91 72.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.511 -176.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.404 HD11 ' HB2' ' A' ' 59' ' ' GLU . 29.2 mt -65.7 -39.45 91.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.008 176.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -68.63 -17.34 64.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.199 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.493 ' HG3' HD12 ' A' ' 55' ' ' ILE . 29.8 mm-40 -73.43 -24.8 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 176.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -86.59 -47.19 16.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.348 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.395 -179.732 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.882 0.373 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.5 m -138.62 127.47 23.71 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.381 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.95 138.88 44.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.409 ' HD3' ' OG ' ' A' ' 24' ' ' SER . 34.9 ttpt -129.79 116.51 18.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -65.9 124.96 23.91 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.729 HG13 ' HG3' ' A' ' 8' ' ' LYS . 18.7 pt -117.18 -38.31 2.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.369 . . . . 0.0 111.319 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.729 ' HG3' HG13 ' A' ' 7' ' ' ILE . 61.5 mtpt -100.67 90.66 4.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.058 0.456 . . . . 0.0 110.243 -177.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.43 -137.22 6.47 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.697 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.429 ' HB3' ' HE2' ' A' ' 10' ' ' LYS . 46.0 mtpt -154.25 -55.62 0.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.1 m -149.88 131.86 15.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.058 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -143.21 123.68 13.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.1 -177.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -85.17 117.58 24.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.93 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.0 t -114.41 106.25 20.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 176.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.73 -91.37 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.845 -177.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.98 6.79 6.43 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.8 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.462 ' N ' HD13 ' A' ' 17' ' ' ILE . 4.0 mp -108.89 129.74 62.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -98.61 105.81 18.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.97 0.414 . . . . 0.0 110.878 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -87.49 143.51 27.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.487 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -133.9 144.22 48.74 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.288 178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -50.02 119.32 3.5 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.628 0.58 . . . . 0.0 112.033 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 -4.67 63.48 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.591 -0.731 . . . . 0.0 113.266 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -106.74 114.15 45.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 117.112 0.456 . . . . 0.0 111.669 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.409 ' OG ' ' HD3' ' A' ' 5' ' ' LYS . 41.4 m -79.12 130.97 36.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.107 171.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -129.78 139.3 51.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.772 0.32 . . . . 0.0 110.76 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -72.62 108.61 5.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 m -109.37 154.68 42.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.175 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.5 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.2 Cg_exo -67.37 164.39 30.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.955 2.436 . . . . 0.0 111.866 174.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -58.01 -40.04 79.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.564 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.47 -48.91 73.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.463 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.5 HD12 ' HD2' ' A' ' 28' ' ' PRO . 59.1 mt -67.47 -27.37 66.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.171 -176.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -58.9 -48.38 81.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.847 0.356 . . . . 0.0 110.137 175.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.39 -37.36 63.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.749 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.401 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 80.5 t80 -55.82 -42.98 76.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.734 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.495 HD21 ' CE1' ' A' ' 41' ' ' PHE . 87.2 mt -85.75 -18.96 31.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.991 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -61.48 -30.86 70.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.347 0.594 . . . . 0.0 109.838 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -82.81 -0.52 48.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.745 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -121.23 114.43 31.98 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.897 0.379 . . . . 0.0 110.951 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -78.16 44.58 1.62 Allowed 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 123.149 2.566 . . . . 0.0 113.542 -173.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -105.16 -15.53 15.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 110.297 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.495 ' CE1' HD21 ' A' ' 35' ' ' LEU . 35.9 m-85 -123.08 153.45 39.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.402 -167.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.514 HG12 HD11 ' A' ' 7' ' ' ILE . 25.9 mm -101.57 108.61 23.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 162.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -90.02 118.64 29.72 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.278 0.561 . . . . 0.0 110.083 -177.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 m . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.211 -175.701 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.509 ' O ' HG22 ' A' ' 55' ' ' ILE . 84.6 Cg_endo . . . . . 0 N--CA 1.45 -1.041 0 N-CA-C 112.912 0.312 . . . . 0.0 112.912 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.792 HG23 HD13 ' A' ' 77' ' ' LEU . 3.8 tp 59.41 23.75 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 115.305 -0.861 . . . . 0.0 113.049 169.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -136.64 38.49 2.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.211 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.464 ' HB2' HD23 ' A' ' 62' ' ' LEU . 68.6 m-85 -94.92 155.94 16.55 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.569 -178.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.564 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -57.53 127.01 29.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.748 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.745 ' HB3' ' HG ' ' A' ' 95' ' ' LEU . 1.9 pp20? -62.79 -26.19 68.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.142 0.496 . . . . 0.0 110.289 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 p -71.59 -30.73 66.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.948 174.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.564 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 30.3 mm-40 -79.49 -40.7 29.12 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.561 175.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' ' 57' ' ' TYR . 92.3 mt -62.96 -20.93 65.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.153 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.596 ' HD3' HD11 ' A' ' 91' ' ' ILE . 0.1 OUTLIER -64.69 -33.46 76.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.916 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.95 -24.04 13.9 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.536 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 24.1 mmt -53.89 138.51 36.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.919 0.39 . . . . 0.0 110.99 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -84.47 -174.79 5.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.298 0.57 . . . . 0.0 111.836 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 63.2 tttm -59.34 -54.41 47.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.421 -178.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.59 84.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.795 -174.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 73' ' ' ILE . 49.1 mt-10 -63.99 -51.46 64.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.517 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.56 ' O ' HG13 ' A' ' 74' ' ' ILE . 26.7 m-70 -55.31 -43.11 74.56 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.095 175.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.565 ' HG2' ' HG2' ' A' ' 81' ' ' PRO . 46.0 mt-10 -60.17 -45.23 93.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.963 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -65.21 -45.04 86.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.744 0.307 . . . . 0.0 110.475 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 69' ' ' GLU . 97.8 mt -55.37 -56.54 11.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.993 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.1 mt -75.02 -25.75 18.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.065 -172.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.9 m -71.56 -27.18 62.98 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.111 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -69.88 -33.25 71.97 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 171.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.792 HD13 HG23 ' A' ' 55' ' ' ILE . 42.3 tp -67.17 -37.64 84.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.182 173.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 123.03 22.4 2.4 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.877 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -146.74 126.09 13.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 111.217 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 17.2 m120 -80.09 137.6 53.18 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.122 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.565 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 8.7 Cg_endo -84.39 48.68 2.52 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.599 2.199 . . . . 0.0 112.237 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.1 p -85.95 -36.08 20.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.656 175.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -66.3 -35.56 80.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.128 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -96.03 108.65 21.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.302 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -94.45 -26.41 16.49 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.993 0.425 . . . . 0.0 110.783 -174.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.497 ' HB3' ' CD ' ' A' ' 89' ' ' GLU . 3.7 t-20 -99.09 151.34 21.07 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.107 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -65.36 -32.68 74.44 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -177.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.38 -55.63 32.31 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.589 0.233 . . . . 0.0 111.386 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.497 ' CD ' ' HB3' ' A' ' 86' ' ' ASN . 1.1 pm0 -60.5 -34.25 73.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.284 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.43 ' O ' HG13 ' A' ' 94' ' ' ILE . 97.5 mtt180 -64.6 -44.24 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.429 177.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.596 HD11 ' HD3' ' A' ' 63' ' ' LYS . 80.7 mt -66.05 -44.87 91.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.127 177.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.33 96.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.5 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.54 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 49.2 t80 -64.4 -42.36 96.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.455 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -69.73 -40.79 79.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 0.0 110.134 177.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.745 ' HG ' ' HB3' ' A' ' 59' ' ' GLU . 0.5 OUTLIER -57.66 -46.1 84.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.813 -179.623 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -76.42 -3.84 39.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -174.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.636 ' HG3' HG12 ' A' ' 55' ' ' ILE . 76.3 mm-40 -80.17 -30.15 38.8 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.4 mt -74.72 -34.88 35.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.591 174.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.779 178.965 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 mmt . . . . . 0 N--CA 1.48 1.05 0 CA-C-O 120.567 0.222 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 40.4 m-85 -105.17 142.24 35.3 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 t -144.14 146.23 32.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.969 0.414 . . . . 0.0 110.604 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.54 145.68 51.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.389 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -134.78 129.62 34.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.915 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.69 HD21 ' H ' ' A' ' 9' ' ' GLY . 2.8 mt -64.09 117.8 7.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -177.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.477 HG23 ' HB ' ' A' ' 42' ' ' ILE . 42.5 pt -108.39 -28.51 2.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.15 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 40' ' ' TYR . 49.1 tptt -88.91 -34.33 16.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.11 -177.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.69 ' H ' HD21 ' A' ' 6' ' ' LEU . . . -105.13 -157.77 23.06 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.672 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 73.3 mmtt -139.9 -41.76 0.43 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.447 HG21 ' HG2' ' A' ' 20' ' ' ARG . 25.4 m -152.34 114.4 4.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.88 172.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.449 ' CB ' HD13 ' A' ' 6' ' ' LEU . 29.6 t80 -136.31 139.14 42.39 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.685 0.278 . . . . 0.0 110.358 -172.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -106.95 112.39 25.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.962 0.411 . . . . 0.0 110.271 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.448 HG13 HD21 ' A' ' 35' ' ' LEU . 78.8 t -102.09 104.34 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 45.2 ttm 65.71 -79.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.742 0.651 . . . . 0.0 110.668 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.38 10.92 2.74 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.1 mm -108.03 139.63 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 m -108.95 113.27 26.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.929 0.395 . . . . 0.0 111.137 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -107.4 148.86 28.56 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.239 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HG2' HG21 ' A' ' 11' ' ' THR . 31.2 mtp85 -133.01 143.29 49.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 175.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.54 ' HB1' ' O ' ' A' ' 9' ' ' GLY . . . -55.28 127.21 28.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.955 0.407 . . . . 0.0 111.317 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.83 -13.28 67.79 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.162 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -103.77 113.49 40.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.703 0.287 . . . . 0.0 110.842 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.3 m -85.53 136.3 33.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -138.05 134.32 34.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -70.39 130.55 42.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 34.0 m -126.74 155.43 75.14 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.881 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.2 Cg_exo -70.88 166.69 28.15 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.855 2.37 . . . . 0.0 111.469 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -56.7 -36.91 70.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -56.33 -51.16 69.27 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.035 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' A' ' 28' ' ' PRO . 83.0 mt -73.77 -30.11 62.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.044 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -59.16 -46.85 87.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.584 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -80.55 -27.2 37.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.33 -41.76 98.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 173.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.463 HD23 ' CE1' ' A' ' 41' ' ' PHE . 79.4 mt -85.33 -8.21 58.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.605 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.441 ' HA ' HD13 ' A' ' 43' ' ' LEU . 15.4 t30 -72.12 -32.2 66.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 172.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -75.98 -39.03 56.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.728 172.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.584 ' HB3' ' HD1' ' A' ' 40' ' ' TYR . 33.1 m-80 -86.44 108.9 19.69 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.548 -175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.18 44.84 1.68 Allowed 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.072 2.514 . . . . 0.0 113.541 -174.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.584 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 63.0 m-85 -102.41 -16.65 16.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 110.951 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 64.4 m-85 -125.35 158.84 33.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.004 0.431 . . . . 0.0 111.61 -169.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.477 ' HB ' HG23 ' A' ' 7' ' ' ILE . 15.8 tt -97.05 131.64 43.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 165.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 36' ' ' ASN . 69.8 mt -108.58 134.41 51.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.398 0.618 . . . . 0.0 111.091 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.7 m -144.43 133.35 22.6 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.69 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -127.4 130.11 48.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.918 0.389 . . . . 0.0 110.044 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.15 151.74 51.97 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.572 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.12 106.08 16.42 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.814 -177.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -74.49 -36.99 63.28 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.742 HD22 ' HB2' ' A' ' 52' ' ' ASP . 28.5 t-20 -87.42 88.7 7.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.666 175.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -76.8 -55.15 5.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.01 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -136.9 121.45 18.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.748 176.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.742 ' HB2' HD22 ' A' ' 49' ' ' ASN . 6.1 t70 -112.18 -156.54 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 172.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -96.74 98.95 4.96 Favored Pre-proline 0 C--N 1.318 -0.793 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.524 ' HG2' ' HB3' ' A' ' 76' ' ' ASN . 56.6 Cg_endo -89.33 76.41 1.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.06 2.507 . . . . 0.0 112.701 -171.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.747 HG12 HD22 ' A' ' 77' ' ' LEU . 8.5 tp -169.65 27.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 122.247 1.022 . . . . 0.0 109.438 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -160.54 109.43 1.67 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.016 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -142.07 174.84 10.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.497 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -64.17 129.43 39.94 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.587 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.3 pp20? -60.27 -31.32 70.11 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -62.02 -37.95 86.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.119 174.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -29.6 42.84 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 120.566 -0.453 . . . . 0.0 110.39 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.444 ' HA ' ' HB2' ' A' ' 65' ' ' MET . 92.1 mt -79.9 -20.25 46.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.102 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 30.2 mmtp -68.04 -30.96 70.31 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.278 0.561 . . . . 0.0 109.962 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.49 26.17 13.77 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.621 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.564 ' HG3' ' HB2' ' A' ' 69' ' ' GLU . 44.0 tpp -104.29 135.48 45.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.662 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 5.6 m-20 -71.92 170.03 14.62 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.782 0.801 . . . . 0.0 112.958 -171.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -58.21 8.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.769 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.45 -24.66 65.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.916 0.389 . . . . 0.0 111.126 -175.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.662 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 8.7 mm-40 -65.04 -54.08 35.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.998 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.522 ' O ' HG13 ' A' ' 74' ' ' ILE . 44.0 m-70 -53.66 -40.66 66.08 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 176.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.97 -49.22 62.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.623 -176.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 p -61.08 -35.83 78.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.63 0.252 . . . . 0.0 110.874 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 69' ' ' GLU . 94.0 mt -55.7 -61.6 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.104 0.478 . . . . 0.0 110.91 175.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.612 ' HA ' HD12 ' A' ' 55' ' ' ILE . 5.7 mt -70.93 -21.38 22.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -173.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 57.9 m -67.7 -35.08 78.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.843 0.354 . . . . 0.0 110.237 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 17.9 m-80 -72.13 -28.32 63.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.406 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.747 HD22 HG12 ' A' ' 55' ' ' ILE . 42.0 tp -64.43 -34.86 79.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.349 172.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 19.43 10.5 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.924 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 159.64 20.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -95.23 107.16 30.49 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.852 0.358 . . . . 0.0 110.627 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.491 ' HB3' HD12 ' A' ' 74' ' ' ILE . 83.9 Cg_endo -82.91 12.78 2.83 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.333 . . . . 0.0 112.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.6 p -77.89 -25.74 48.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.24 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.77 -37.54 59.16 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.087 0.47 . . . . 0.0 109.879 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -81.98 108.59 15.6 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -105.29 -29.59 10.2 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -170.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -89.68 153.24 20.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.84 0.353 . . . . 0.0 110.601 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.8 91.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -54.64 -48.79 71.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.94 -50.51 73.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.409 0.623 . . . . 0.0 110.807 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.403 ' O ' HG13 ' A' ' 94' ' ' ILE . 90.3 mtt180 -67.24 -39.94 86.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.016 -174.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.3 mt -70.05 -44.24 78.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.681 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.02 -42.4 99.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 0.0 111.335 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.24 -40.55 96.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 90' ' ' ARG . 79.0 mt -67.51 -34.89 71.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 178.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.635 ' O ' HG21 ' A' ' 98' ' ' ILE . 53.3 mt -67.36 -23.7 65.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.567 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -30.18 71.3 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.318 176.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 55' ' ' ILE . 2.7 mp0 -88.27 -25.07 23.01 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.395 -178.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.635 HG21 ' O ' ' A' ' 95' ' ' LEU . 8.3 tp -70.47 -22.18 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 173.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -81.53 -25.09 36.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.405 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.467 ' HB2' ' HA ' ' A' ' 97' ' ' GLN . 5.9 m-80 -78.59 -19.81 51.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.238 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -83.14 81.62 8.61 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 170.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.02 -40.91 4.75 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.055 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -134.06 155.95 49.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.331 0.586 . . . . 0.0 111.803 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -126.02 -58.57 1.37 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.588 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -93.06 72.98 4.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.778 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -87.5 5.85 37.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.627 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -89.12 147.33 24.27 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.579 -176.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.2 p-80 -77.0 175.2 9.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.525 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 67.63 9.24 6.92 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.525 0.679 . . . . 0.0 110.431 -176.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.31 62.67 0.76 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.136 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 80.2 t60 . . . . . 0 C--O 1.245 0.857 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.64 -175.179 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.609 ' HB2' ' HB2' ' A' ' 46' ' ' GLU . 81.3 mtp . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 120.568 0.223 . . . . 0.0 110.633 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -97.87 103.46 15.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 85.1 m -112.74 130.36 56.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.205 0.526 . . . . 0.0 111.314 -174.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -114.21 146.1 40.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.176 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -133.97 129.62 36.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.387 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -67.78 118.94 11.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.664 HG13 ' HG3' ' A' ' 8' ' ' LYS . 38.4 pt -109.25 -25.66 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.591 -176.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.664 ' HG3' HG13 ' A' ' 7' ' ' ILE . 99.2 mttt -122.06 96.79 5.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 0.0 111.115 -177.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.22 -118.52 0.99 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.878 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 2.2 ttmp? -175.61 -58.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.449 HG22 ' HG2' ' A' ' 20' ' ' ARG . 4.0 p -141.26 118.11 11.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.28 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -136.35 133.41 36.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.918 0.389 . . . . 0.0 110.634 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -97.24 110.5 23.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.892 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.83 92.01 3.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 173.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 35.1 mtm 62.78 -86.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.688 -176.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -124.23 12.54 8.02 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.536 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.8 mp -120.46 125.3 73.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.734 0.267 . . . . 0.0 110.478 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.4 m -89.95 109.36 20.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.516 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.434 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 81.0 m-85 -92.83 131.2 38.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.995 176.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HG2' HG22 ' A' ' 11' ' ' THR . 80.7 mtt180 -114.79 143.72 44.63 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.22 115.03 2.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.184 178.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.16 -9.49 59.58 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.837 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.9 t -100.72 115.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.881 0.372 . . . . 0.0 110.969 -178.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m -84.95 136.32 33.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.308 176.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.407 ' C ' HG22 ' A' ' 3' ' ' THR . 97.4 mt-30 -141.08 128.21 20.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.208 -177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.5 m -72.72 127.13 31.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.821 0.343 . . . . 0.0 110.273 178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 m -118.68 163.43 25.81 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.685 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.503 ' HD2' HD13 ' A' ' 31' ' ' LEU . 16.7 Cg_exo -69.09 155.76 67.16 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.445 2.096 . . . . 0.0 110.576 169.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -63.94 -24.24 67.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.565 0.221 . . . . 0.0 111.275 -175.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -55.21 -41.45 72.04 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.12 0.486 . . . . 0.0 110.275 171.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.503 HD13 ' HD2' ' A' ' 28' ' ' PRO . 65.9 mt -84.32 -21.93 30.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.84 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.19 -47.38 80.02 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.95 -36.64 75.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.506 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.86 -39.88 95.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.842 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.47 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.7 mt -85.15 -12.08 53.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 178.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -68.26 -33.54 74.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -73.96 -15.1 61.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.953 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -122.44 86.43 48.47 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -71.91 13.59 0.48 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.367 2.711 . . . . 0.0 114.611 -168.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.501 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 15.5 p90 -90.93 14.83 12.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.467 0.651 . . . . 0.0 110.515 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.47 ' CE1' HD22 ' A' ' 35' ' ' LEU . 88.8 m-85 -118.26 148.4 42.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.702 169.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.451 ' HB ' HG23 ' A' ' 7' ' ' ILE . 16.5 tt -97.45 129.88 46.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -107.34 114.63 28.79 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.234 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.6 m -126.45 126.49 43.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.64 -176.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -89.91 124.64 34.88 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.088 177.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.609 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 42.8 mt-10 -101.58 117.21 34.45 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 83.7 mt -119.41 99.9 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.337 -174.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 58.5 t30 74.45 146.9 0.09 Allowed 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.054 0.846 . . . . 0.0 112.386 171.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -122.71 -22.1 5.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.26 178.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -91.62 107.73 19.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.2 -173.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -120.78 58.22 0.95 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.477 0.656 . . . . 0.0 109.946 168.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -93.93 16.87 13.3 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 168.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 63.66 81.05 0.23 Allowed Pre-proline 0 C--O 1.232 0.18 0 CA-C-N 113.665 -1.607 . . . . 0.0 109.439 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.635 ' O ' HG21 ' A' ' 73' ' ' ILE . 94.8 Cg_endo -77.41 37.72 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.615 2.877 . . . . 0.0 113.071 -172.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tp -145.06 24.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 122.395 1.093 . . . . 0.0 108.084 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -144.66 94.42 2.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.876 -173.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.504 ' HB2' HD11 ' A' ' 62' ' ' LEU . 77.3 m-85 -141.51 160.6 39.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.235 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.468 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 9.4 m -65.45 126.52 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.005 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -64.61 -26.91 68.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.222 0.534 . . . . 0.0 109.642 177.845 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.438 ' H ' HG21 ' A' ' 58' ' ' THR . 9.2 m -68.72 -30.05 68.6 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.609 175.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 13.3 mm-40 -82.1 -44.21 16.82 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.948 0.404 . . . . 0.0 110.341 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.504 HD11 ' HB2' ' A' ' 57' ' ' TYR . 88.1 mt -69.03 -12.69 61.91 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.549 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.7 OUTLIER -67.78 -53.61 25.82 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.472 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.67 57.96 1.89 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.734 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.4 ' HG3' ' HA ' ' A' ' 62' ' ' LEU . 12.0 mmt -120.0 -169.49 1.79 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.583 0.706 . . . . 0.0 111.42 -177.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.5 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 39.0 t30 -100.14 -166.35 1.32 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.829 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.5 ' H ' ' CG ' ' A' ' 66' ' ' ASN . 1.4 ttpm? -100.6 -36.98 8.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.767 0.317 . . . . 0.0 110.561 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.496 ' HA ' ' OE1' ' A' ' 71' ' ' GLU . . . -62.78 -36.45 83.14 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.484 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -74.7 -39.39 61.98 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.032 -176.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.511 ' HA ' HD12 ' A' ' 73' ' ' ILE . 64.6 m80 -56.1 -42.78 77.33 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 120.621 0.248 . . . . 0.0 110.814 172.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 42.0 mt-10 -60.72 -46.72 89.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.229 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.445 ' O ' ' HB2' ' A' ' 76' ' ' ASN . 22.8 m -67.77 -31.42 71.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.126 178.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.635 HG21 ' O ' ' A' ' 54' ' ' PRO . 30.7 mt -58.44 -57.6 10.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.527 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -86.64 -11.83 11.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.97 -171.735 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 p -81.03 -34.57 32.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 72' ' ' SER . 4.4 t-20 -65.18 -34.58 78.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.608 0.718 . . . . 0.0 109.265 174.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.402 HD23 ' OE1' ' A' ' 97' ' ' GLN . 53.4 tp -63.25 -25.16 68.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.997 175.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.97 11.29 60.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.241 -177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.578 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 1.6 tpm_? -93.0 -35.57 13.2 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 122.9 -0.177 . . . . 0.0 110.832 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.446 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 38.3 t30 70.45 108.96 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.721 0.638 . . . . 0.0 111.055 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.514 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 2.9 Cg_exo -75.16 65.17 6.21 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.953 2.435 . . . . 0.0 112.943 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 t -92.37 -29.21 16.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.389 . . . . 0.0 110.631 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.29 -23.96 32.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.259 0.552 . . . . 0.0 111.131 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -82.44 126.73 32.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.878 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -108.76 -57.82 2.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.563 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -89.7 154.34 20.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.445 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -61.04 -30.82 70.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.648 0.261 . . . . 0.0 110.63 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.58 -54.29 39.51 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.311 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.41 -37.38 70.11 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.308 0.575 . . . . 0.0 110.634 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.443 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.3 mtt-85 -68.25 -45.74 72.38 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.422 -178.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 87' ' ' ALA . 75.4 mt -65.13 -43.67 95.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.621 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.5 80.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.484 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -71.26 -43.42 67.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.209 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 90' ' ' ARG . 91.7 mt -59.45 -43.03 89.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.133 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.495 HD21 HD13 ' A' ' 98' ' ' ILE . 19.1 mt -57.52 -39.04 75.68 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.281 174.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -68.33 -27.58 66.4 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.001 -174.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.497 ' N ' HE21 ' A' ' 97' ' ' GLN . 0.0 OUTLIER -83.37 -19.56 35.87 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.69 178.425 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.495 HD13 HD21 ' A' ' 95' ' ' LEU . 71.0 mt -67.48 -42.06 86.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 170.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -62.61 -40.73 97.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.684 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -90.44 17.83 6.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.747 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -83.12 80.35 9.08 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.1 61.72 4.09 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.857 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -98.2 21.27 11.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.755 0.788 . . . . 0.0 109.193 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.6 ' HA ' ' HB2' ' A' ' 108' ' ' HIS . 78.6 mt -84.3 76.48 10.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.651 -178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -86.17 94.37 9.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.978 178.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 66.3 m-70 52.3 58.05 5.81 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.405 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 106' ' ' HIS . 32.5 m170 70.81 110.36 0.06 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.307 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.6 ' HB2' ' HA ' ' A' ' 104' ' ' LEU . 16.1 t-80 -81.82 93.48 6.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.653 -175.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -167.33 -21.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.781 -178.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 77.24 109.49 0.08 Allowed 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.781 0.675 . . . . 0.0 112.076 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.0 173.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.444 ' HE3' ' HA ' ' A' ' 48' ' ' ASN . 21.7 ptt? . . . . . 0 N--CA 1.481 1.101 0 CA-C-O 120.782 0.325 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.508 ' O ' ' HA ' ' A' ' 26' ' ' THR . 76.3 m-85 -134.85 153.03 52.21 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.468 HG23 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -104.69 122.27 45.31 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.963 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.65 133.0 56.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.1 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -132.35 133.97 44.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.237 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.57 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 2.8 mt -67.07 125.36 25.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.157 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.641 HG13 ' HG3' ' A' ' 8' ' ' LYS . 32.0 pt -111.64 -15.77 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.109 0.481 . . . . 0.0 110.676 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.641 ' HG3' HG13 ' A' ' 7' ' ' ILE . 67.5 mttm -130.14 134.0 47.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.298 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.96 -124.44 7.52 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.052 175.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -160.99 -59.64 0.05 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.975 0.416 . . . . 0.0 109.937 -171.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.468 HG23 ' HG2' ' A' ' 20' ' ' ARG . 32.6 m -153.08 121.15 6.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.278 -178.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -133.98 126.05 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -98.3 117.98 33.91 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.323 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.686 HG23 HD22 ' A' ' 35' ' ' LEU . 21.4 t -111.91 106.14 20.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.673 -178.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 38.1 tpp 71.38 -1.52 2.73 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.634 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.36 -29.0 3.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.65 -177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.49 HD11 HD12 ' A' ' 31' ' ' LEU . 2.2 mp -82.44 119.93 32.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.0 m -90.01 114.79 26.71 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.078 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -100.08 143.18 30.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.015 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.468 ' HG2' HG23 ' A' ' 11' ' ' THR . 51.6 mtm180 -124.28 142.24 51.42 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.57 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -53.02 113.64 1.17 Allowed 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.426 0.454 . . . . 0.0 111.377 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.58 -13.99 27.5 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.927 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.1 t -104.69 111.31 33.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.964 0.382 . . . . 0.0 111.602 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.468 ' HB3' HG23 ' A' ' 3' ' ' THR . 20.1 m -79.43 137.03 37.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.586 173.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.22 151.83 44.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.508 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 7.6 p -82.97 124.01 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.187 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.497 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 21.3 m -118.37 154.34 52.06 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.927 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -73.56 173.51 13.75 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.773 2.982 . . . . 0.0 113.348 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -49.47 -46.6 48.27 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.667 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.8 mmtm -57.59 -53.8 54.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.095 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.497 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 45.5 mt -67.48 -33.88 76.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -175.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -59.69 -40.96 89.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -79.96 -38.37 32.45 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.417 0.627 . . . . 0.0 110.352 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -39.77 91.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.274 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.686 HD22 HG23 ' A' ' 14' ' ' VAL . 91.6 mt -85.06 -19.12 32.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.714 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -62.06 -32.41 72.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.75 175.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -85.7 3.09 42.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.908 176.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -131.17 94.76 26.59 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.78 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.3 34.48 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.452 2.768 . . . . 0.0 114.621 -169.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.508 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.2 p90 -112.5 8.88 19.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.678 0.751 . . . . 0.0 110.515 172.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.439 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 61.1 m-85 -115.01 148.14 39.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.369 168.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.564 ' HB ' HG23 ' A' ' 7' ' ' ILE . 11.2 tp -96.99 122.77 48.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.254 170.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.9 mt -105.01 114.91 29.39 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.862 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.9 m -126.74 123.71 38.08 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.212 0.529 . . . . 0.0 110.512 -178.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -90.01 104.74 17.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.833 177.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.04 129.88 54.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.403 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.07 113.45 12.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.596 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.444 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 5.0 m-20 69.26 13.69 8.56 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.097 173.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -91.07 147.94 22.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.905 0.383 . . . . 0.0 110.636 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -132.57 -149.82 0.39 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.362 -177.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -81.02 76.03 7.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.384 0.612 . . . . 0.0 109.977 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -84.02 95.74 8.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.511 176.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.31 114.74 18.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.517 -177.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.496 ' O ' HG23 ' A' ' 55' ' ' ILE . 5.4 Cg_exo -79.64 157.52 24.92 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.986 2.457 . . . . 0.0 111.988 177.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.551 HG12 HD23 ' A' ' 77' ' ' LEU . 7.6 tp 54.35 26.15 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.315 1.046 . . . . 0.0 112.163 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -148.54 88.42 1.63 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.146 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -142.64 152.62 42.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.947 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.998 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.4 m -59.29 130.89 49.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.411 175.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.612 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 16.9 pt-20 -61.88 -35.27 77.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.135 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 p -66.57 -30.28 70.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 174.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.998 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 55.9 mm-40 -72.54 -39.55 67.41 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.61 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.528 HD23 ' SD ' ' A' ' 65' ' ' MET . 83.2 mt -74.86 -14.46 60.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.386 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 65.3 mmtt -65.12 -47.28 77.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.821 0.343 . . . . 0.0 110.649 177.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.31 53.94 1.8 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.494 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.528 ' SD ' HD23 ' A' ' 62' ' ' LEU . 95.7 mtp -138.09 162.01 35.29 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -94.87 168.54 10.74 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 20.6 pttp -74.28 -27.35 60.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -169.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.07 -49.48 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.533 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.2 mp0 -57.94 -51.49 69.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.707 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.508 ' O ' HG13 ' A' ' 74' ' ' ILE . 82.0 m-70 -49.89 -40.43 42.84 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.548 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 56.4 mt-10 -65.8 -45.33 82.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.209 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.7 p -74.09 -36.82 64.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.984 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.0 mt -55.09 -59.87 2.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 177.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 70' ' ' HIS . 4.6 mt -76.84 -21.6 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -173.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 71' ' ' GLU . 19.3 t -64.43 -33.58 76.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -72.96 -37.32 67.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.175 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.551 HD23 HG12 ' A' ' 55' ' ' ILE . 45.6 tp -59.06 -38.51 79.56 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.434 175.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.41 -43.72 0.87 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.28 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -101.18 107.19 18.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.776 0.322 . . . . 0.0 110.883 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -69.89 124.4 90.57 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.548 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 42.3 Cg_endo -69.05 73.9 1.01 Allowed 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.609 2.206 . . . . 0.0 114.021 -172.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.4 t -104.04 -20.85 13.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.25 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -87.96 8.73 24.98 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.39 0.614 . . . . 0.0 110.174 175.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -119.08 122.83 42.99 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -87.0 -58.9 2.42 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.779 -173.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -92.24 -179.91 5.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 111.434 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.431 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -74.3 -36.59 63.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.679 -176.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -64.33 -38.03 89.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.262 -176.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -58.51 -39.54 80.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.468 ' O ' HG13 ' A' ' 94' ' ' ILE . 77.1 mtt85 -70.4 -40.42 73.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.756 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 87' ' ' ALA . 79.5 mt -63.37 -41.74 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.269 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.67 96.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.219 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -63.91 -38.42 91.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.325 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.47 HG12 HD13 ' A' ' 55' ' ' ILE . 65.8 mt -65.54 -47.52 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 177.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.489 HD21 HD12 ' A' ' 98' ' ' ILE . 30.4 mt -60.58 -36.37 78.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.953 0.406 . . . . 0.0 111.65 178.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.6 ttpt -63.35 -32.25 73.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.319 -175.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.23 -28.71 47.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 0.0 110.786 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.489 HD12 HD21 ' A' ' 95' ' ' LEU . 63.9 mt -68.23 -40.31 82.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 109.685 175.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.18 -58.12 3.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.23 177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -86.71 74.08 9.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.161 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.435 ' HG3' ' H ' ' A' ' 102' ' ' GLY . 12.1 pttm -93.22 -67.51 0.85 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.531 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.435 ' H ' ' HG3' ' A' ' 101' ' ' LYS . . . 86.11 -42.82 3.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.803 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -73.84 122.05 21.87 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.9 mp -85.38 110.61 19.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.962 0.411 . . . . 0.0 110.727 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -77.39 130.06 36.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.797 175.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -141.53 23.82 2.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -97.25 22.95 7.97 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -65.48 -20.27 66.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.995 -173.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.25 -13.23 17.1 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.375 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.94 26.94 3.28 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.787 0.327 . . . . 0.0 110.465 175.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.808 -0.615 . . . . 0.0 110.167 -178.147 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -91.3 135.11 34.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.601 0.238 . . . . 0.0 111.072 -174.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.8 p -126.22 139.65 53.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.03 136.27 45.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.775 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 5.6 ptpp? -133.25 143.57 49.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.973 0.416 . . . . 0.0 110.775 177.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.683 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -70.76 140.56 51.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.503 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.515 HD13 HG13 ' A' ' 42' ' ' ILE . 43.1 pt -122.82 -43.93 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 67.8 mttm -94.89 94.09 7.83 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.038 0.447 . . . . 0.0 110.462 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.05 -116.04 0.98 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.103 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -179.03 -55.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.9 m -140.57 115.5 9.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.33 176.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -135.87 133.8 38.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.533 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 64.5 t30 -102.35 121.61 42.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.091 -176.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.6 t -108.55 106.64 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.214 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.5 mtt 64.48 -85.84 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.993 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -136.19 9.01 4.12 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 121.251 -0.499 . . . . 0.0 111.887 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.466 HD12 HD12 ' A' ' 31' ' ' LEU . 3.8 mp -118.59 112.76 39.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.6 m -88.56 122.94 32.56 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.039 0.447 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -103.36 143.8 32.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.471 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -120.11 146.04 46.33 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.829 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.683 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.53 115.49 2.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.304 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.65 -16.59 60.23 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.693 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -103.28 110.97 31.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.79 0.328 . . . . 0.0 110.208 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.775 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 20.3 m -82.77 136.52 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.253 0.549 . . . . 0.0 111.877 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -114.54 149.41 36.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.436 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -81.68 119.28 23.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 27.7 m -119.44 152.7 53.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.832 0.349 . . . . 0.0 111.574 -173.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.407 ' HD2' HD11 ' A' ' 31' ' ' LEU . 13.3 Cg_exo -71.51 177.38 6.84 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.134 2.556 . . . . 0.0 112.087 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.0 -39.51 86.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.469 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -59.37 -52.82 63.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.313 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 67.3 mt -68.14 -28.91 67.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.393 -175.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -60.87 -52.9 63.1 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -73.47 -31.36 63.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.342 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -61.41 -50.39 73.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB2' HD23 ' A' ' 43' ' ' LEU . 80.1 mt -81.41 -16.9 50.73 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.841 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -69.49 -29.54 67.21 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.301 0.572 . . . . 0.0 109.67 175.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.18 -20.85 37.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.568 177.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -94.51 111.35 53.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.433 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.76 29.7 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.262 2.642 . . . . 0.0 114.554 -168.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.465 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.1 p90 -129.21 19.34 5.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.295 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -130.87 136.91 49.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.515 HG13 HD13 ' A' ' 7' ' ' ILE . 4.0 mt -97.8 124.63 50.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.497 HD23 ' HB2' ' A' ' 35' ' ' LEU . 5.5 mp -122.07 131.12 53.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.357 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.7 m -125.48 124.97 42.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.451 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.76 113.28 24.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.232 0.539 . . . . 0.0 110.319 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -102.04 151.15 22.49 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.166 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.8 mp -82.56 166.96 18.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -112.32 -178.18 3.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -65.16 124.1 21.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.924 0.392 . . . . 0.0 111.07 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -85.6 168.64 14.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.486 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.2 119.62 24.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.161 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -82.32 88.91 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -53.89 110.65 2.2 Favored Pre-proline 0 N--CA 1.469 0.476 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.412 -171.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.629 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 57.2 Cg_endo -95.74 102.58 0.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.654 2.903 . . . . 0.0 113.334 -176.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.629 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 10.9 tp 163.15 29.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 122.196 0.998 . . . . 0.0 108.569 177.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.49 ' HA ' HD11 ' A' ' 98' ' ' ILE . 27.3 t30 -158.33 89.48 0.98 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.092 -171.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -139.17 164.94 28.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.783 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -64.74 145.16 56.63 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -58.88 -37.56 76.86 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 174.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.5 m -63.68 -32.84 74.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.25 174.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -28.59 62.05 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.319 0.58 . . . . 0.0 110.378 177.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.438 ' HB3' HG12 ' A' ' 91' ' ' ILE . 91.4 mt -87.77 -18.82 28.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.259 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -71.06 -43.24 68.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.035 0.445 . . . . 0.0 110.527 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -2.0 90.28 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.922 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.67 ' HG3' ' HG3' ' A' ' 69' ' ' GLU . 49.9 ttm -88.58 131.87 34.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 122.523 0.329 . . . . 0.0 110.34 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.463 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 22.9 m-80 -81.29 175.01 10.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.815 0.34 . . . . 0.0 111.113 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.43 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 19.7 ptmt -67.73 -39.28 84.3 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.07 -53.14 61.43 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.455 -174.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.67 ' HG3' ' HG3' ' A' ' 65' ' ' MET . 3.9 pm0 -65.63 -45.88 81.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.89 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.551 ' O ' HG13 ' A' ' 74' ' ' ILE . 17.4 m-70 -44.53 -53.17 7.31 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.02 -42.63 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.46 -176.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.2 m -61.15 -40.69 94.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.848 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 69' ' ' GLU . 79.8 mt -59.21 -58.66 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.527 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.0 mt -70.8 -24.95 25.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.917 0.389 . . . . 0.0 111.13 -173.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.6 m -68.29 -30.18 69.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.785 0.326 . . . . 0.0 110.233 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -75.17 -26.13 58.84 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.384 175.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 74' ' ' ILE . 50.4 tp -63.02 -32.94 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.495 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.51 5.09 30.1 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.868 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.405 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 2.1 tmt_? -128.49 99.2 5.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -70.6 129.52 89.94 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.017 -173.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -83.98 43.89 1.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.037 2.492 . . . . 0.0 112.11 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.8 t -70.41 -30.16 66.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.153 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.19 -18.06 35.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 110.588 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -85.47 118.38 24.96 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -111.62 -19.18 12.6 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.86 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 3.5 m-20 -97.45 145.26 26.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.399 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.01 -33.5 75.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.16 -177.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.42 -39.67 77.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.462 ' CD ' ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp0 -60.65 -33.8 73.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.966 0.413 . . . . 0.0 110.274 175.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 71.6 mtt-85 -67.07 -40.6 87.05 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.438 HG12 ' HB3' ' A' ' 62' ' ' LEU . 97.0 mt -63.15 -45.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.75 93.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.592 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.405 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 33.3 t80 -70.4 -39.43 74.51 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.635 -178.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -67.79 -34.71 69.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.8 mt -64.67 -28.62 69.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.887 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' O ' ' HD3' ' A' ' 96' ' ' LYS . 5.0 tmtm? -77.21 -28.24 53.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.017 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -6.73 58.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.002 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.49 HD11 ' HA ' ' A' ' 56' ' ' ASN . 48.0 mm -57.02 -40.27 71.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.674 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.46 -49.86 69.77 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.935 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -61.84 -46.35 89.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.714 -173.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.581 ' HE3' ' CG2' ' A' ' 55' ' ' ILE . 66.2 mmtt -80.73 -55.99 4.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.705 -175.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 62.66 -105.93 1.13 Allowed Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.893 -176.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -161.75 163.93 29.28 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 mp -86.32 144.13 27.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.477 ' HG3' ' H ' ' A' ' 107' ' ' HIS . 11.6 tp10 -70.19 133.65 47.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.941 177.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -104.97 26.44 9.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.26 -175.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.477 ' H ' ' HG3' ' A' ' 105' ' ' GLU . 4.9 t-80 -62.97 105.72 0.72 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.269 0.557 . . . . 0.0 109.832 -178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -97.32 147.81 23.78 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.578 -171.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -116.85 86.69 2.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.791 -177.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.466 ' HB3' ' H ' ' A' ' 111' ' ' HIS . 0.1 OUTLIER -176.39 -84.4 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -176.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.466 ' H ' ' HB3' ' A' ' 110' ' ' HIS . 55.9 t-80 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.036 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' O ' ' HA ' ' A' ' 45' ' ' GLN . 26.4 ptt? . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.2 111.36 23.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.425 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.523 ' HB ' ' HB3' ' A' ' 24' ' ' SER . 17.5 p -108.5 131.67 54.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.026 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.79 148.62 28.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.155 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -147.13 132.43 18.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.2 -174.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 6' ' ' LEU . 2.6 mm? -65.31 125.53 25.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.777 175.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.873 HD12 ' HG3' ' A' ' 8' ' ' LYS . 2.7 pp -109.72 -4.63 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.416 0.626 . . . . 0.0 110.36 175.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.873 ' HG3' HD12 ' A' ' 7' ' ' ILE . 61.8 mttm -138.11 127.38 24.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.997 173.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.69 -128.73 8.44 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.311 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -172.68 -48.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.0 m -152.27 128.95 10.81 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -148.92 133.41 17.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.643 0.259 . . . . 0.0 110.741 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.535 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 26.2 t-20 -96.26 123.1 39.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.548 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.5 t -110.54 106.49 20.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.005 177.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 66.35 -74.22 0.06 Allowed 'General case' 0 N--CA 1.466 0.364 0 O-C-N 123.941 0.776 . . . . 0.0 111.363 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.01 -0.36 1.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.683 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.497 HD11 ' N ' ' A' ' 17' ' ' ILE . 3.2 mp -113.0 121.01 64.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.7 m -92.93 105.54 17.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.788 0.328 . . . . 0.0 110.653 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -93.73 161.77 14.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.167 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -133.8 154.65 50.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.321 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.45 130.73 45.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.771 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.99 -5.54 84.98 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.688 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.9 t -111.38 107.66 23.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.745 0.307 . . . . 0.0 110.638 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.523 ' HB3' ' HB ' ' A' ' 3' ' ' THR . 13.0 m -85.53 111.62 20.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.396 178.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -111.93 143.66 42.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.138 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -67.83 128.0 34.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.19 157.42 51.03 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.576 -176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.511 ' HD2' HD13 ' A' ' 31' ' ' LEU . 20.5 Cg_exo -67.31 168.82 16.79 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.27 2.647 . . . . 0.0 112.263 175.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -56.48 -48.9 76.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.804 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -58.45 -47.99 82.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.231 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.511 HD13 ' HD2' ' A' ' 28' ' ' PRO . 42.2 mt -69.29 -27.46 65.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.842 -175.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -57.78 -50.47 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 110.605 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.24 -29.56 38.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.859 0.361 . . . . 0.0 110.558 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.64 -42.15 98.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.5 mt -82.83 -19.78 36.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -70.52 -23.6 62.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.67 0.747 . . . . 0.0 109.316 173.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -92.69 7.85 41.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.474 176.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -108.35 133.21 20.65 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.278 -177.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.12 -11.76 21.27 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.982 2.455 . . . . 0.0 114.832 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.419 ' CB ' ' HB2' ' A' ' 8' ' ' LYS . 6.9 p90 -118.62 23.71 11.32 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.235 -178.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -129.23 119.37 23.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.94 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.61 HD13 HG21 ' A' ' 7' ' ' ILE . 14.4 mt -106.39 125.11 62.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 170.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.12 156.67 19.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.0 m -143.22 138.94 30.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.21 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.425 ' HA ' ' O ' ' A' ' 1' ' ' MET . 3.3 pm0 -110.56 117.76 34.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.216 0.532 . . . . 0.0 110.36 178.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -123.96 161.96 24.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.235 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.4 mp -81.19 159.21 24.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.963 -178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -133.68 -37.66 0.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.067 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -90.41 131.75 36.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.657 -178.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -94.59 152.17 18.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.23 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.562 ' NZ ' ' HA ' ' A' ' 54' ' ' PRO . 19.5 pttp -99.01 26.85 5.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.053 0.454 . . . . 0.0 110.388 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.0 t70 72.56 -69.15 0.2 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.477 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 9.7 t70 -121.68 123.79 27.36 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 121.014 0.435 . . . . 0.0 110.528 -177.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.562 ' HA ' ' NZ ' ' A' ' 51' ' ' LYS . 93.6 Cg_endo -99.55 32.08 0.11 Allowed 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 122.881 2.387 . . . . 0.0 114.209 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.692 HD11 ' HA ' ' A' ' 94' ' ' ILE . 6.5 tp -178.7 78.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.061 0.934 . . . . 0.0 110.79 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.53 ' OD1' HG13 ' A' ' 98' ' ' ILE . 4.9 t30 -170.15 86.39 0.12 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.801 -176.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.506 ' HB2' HD12 ' A' ' 62' ' ' LEU . 94.4 m-85 -141.39 152.01 43.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.748 0.308 . . . . 0.0 110.925 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.668 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 4.4 m -73.61 143.83 46.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.338 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.535 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 7.0 pt-20 -67.36 -38.71 85.22 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.292 177.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 16.2 m -63.16 -27.58 69.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.291 0.567 . . . . 0.0 109.748 174.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.668 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 39.0 tt0 -78.77 -43.52 25.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.226 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.541 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 96.6 mt -79.26 -18.33 52.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.013 -178.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -62.92 -31.42 72.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.787 0.327 . . . . 0.0 110.337 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -102.0 21.84 40.36 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.899 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 25.0 mmt -107.95 146.34 32.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.845 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.756 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 14.4 m120 -71.3 169.64 14.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.52 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 43.3 mtmt -60.41 -50.88 71.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.025 176.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.52 -29.11 67.65 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.659 0.6 . . . . 0.0 111.752 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.756 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 4.9 mm-40 -66.23 -46.38 77.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.705 0.764 . . . . 0.0 109.389 177.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.667 ' HE1' HD13 ' A' ' 91' ' ' ILE . 30.6 m-70 -63.09 -38.94 93.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.103 175.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 42.9 mt-10 -68.29 -34.61 76.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.629 -175.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.8 p -70.42 -34.6 72.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.226 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 69' ' ' GLU . 85.5 mt -58.32 -61.73 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.576 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.517 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -73.6 -13.52 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.4 p -79.49 -32.87 42.53 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.366 -0.534 . . . . 0.0 109.749 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -71.14 -29.45 65.25 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.165 0.507 . . . . 0.0 109.724 173.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.6 tp -73.23 -26.58 61.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.648 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.77 -6.14 67.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.255 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.557 ' HA ' ' HE ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -73.11 -36.74 66.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.787 0.327 . . . . 0.0 110.199 -179.757 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 79' ' ' ARG . 45.9 m-80 72.38 137.64 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.171 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.517 ' HA ' HD13 ' A' ' 74' ' ' ILE . 6.1 Cg_endo -78.49 -4.18 13.96 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.695 2.263 . . . . 0.0 113.237 -175.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.44 -10.78 57.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.937 0.399 . . . . 0.0 111.464 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -82.72 -15.02 53.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.241 0.544 . . . . 0.0 110.504 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -119.24 146.68 45.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.754 -173.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.757 ' HZ2' ' HB3' ' A' ' 85' ' ' LYS . 5.4 ttpm? -108.76 -65.04 1.17 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 0.0 110.597 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -76.52 157.48 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.914 -176.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.67 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -63.29 -36.78 84.8 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.18 -49.05 67.47 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.281 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.422 ' OE2' ' HB3' ' A' ' 85' ' ' LYS . 40.7 mt-10 -58.29 -37.75 75.65 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.355 0.598 . . . . 0.0 110.493 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 90' ' ' ARG . 4.9 mtm180 -73.45 -34.03 65.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.613 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 87' ' ' ALA . 22.7 mm -63.4 -50.06 80.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 176.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.68 -45.17 81.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.043 -176.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.444 ' CZ ' ' HG3' ' A' ' 79' ' ' ARG . 41.3 t80 -67.15 -47.61 70.52 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.457 -176.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.692 ' HA ' HD11 ' A' ' 55' ' ' ILE . 61.6 mt -67.32 -38.97 81.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.969 0.414 . . . . 0.0 110.211 -178.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.501 HD13 HG23 ' A' ' 98' ' ' ILE . 4.4 mm? -73.23 -16.71 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.459 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -74.35 -43.46 56.52 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.454 ' O ' ' HB3' ' A' ' 101' ' ' LYS . 2.8 mp0 -76.44 -25.81 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.968 -176.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.564 ' O ' ' HA3' ' A' ' 102' ' ' GLY . 14.1 tt -73.31 -14.7 16.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.529 0.68 . . . . 0.0 109.957 175.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -101.59 -49.33 4.04 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.614 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -66.67 -43.24 85.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.063 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.489 ' HE2' HG21 ' A' ' 55' ' ' ILE . 22.6 ttpp -96.38 -29.92 13.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.371 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.564 ' HA3' ' O ' ' A' ' 98' ' ' ILE . . . -74.21 -1.86 61.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.391 -175.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.13 -21.28 43.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.168 0.509 . . . . 0.0 109.922 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -80.44 93.95 6.1 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.847 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -73.18 -2.4 21.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.387 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -63.03 -31.08 72.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.264 172.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -96.33 77.64 3.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 173.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.81 95.87 9.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.91 -169.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -141.63 20.74 2.18 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.334 171.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -73.32 -57.71 3.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.973 176.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 10.8 p80 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.401 176.506 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttp . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -93.63 126.84 39.02 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.77 131.97 49.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.862 0.363 . . . . 0.0 110.823 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.77 134.26 52.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.429 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -136.65 124.85 23.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.575 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.48 HD21 ' CB ' ' A' ' 19' ' ' PHE . 2.7 mm? -67.57 141.04 56.95 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.28 0.562 . . . . 0.0 111.01 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.524 HD11 HG13 ' A' ' 42' ' ' ILE . 39.1 pt -121.33 -2.4 8.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.473 174.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.481 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 95.0 mttt -144.34 149.4 36.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.294 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.39 -28.77 10.1 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.279 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.434 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 80.7 tttt 73.78 -37.12 0.36 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.775 0.83 . . . . 0.0 111.504 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.9 m -151.77 123.57 8.0 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -138.88 139.93 38.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 110.387 -174.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -102.9 123.42 46.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.812 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -117.85 102.06 12.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.2 mtt 63.64 -87.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.058 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.17 0.2 6.51 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.447 ' N ' HD13 ' A' ' 17' ' ' ILE . 3.4 mp -105.31 125.33 60.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.8 m -95.65 117.34 30.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.838 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.565 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 95.8 m-85 -107.04 157.54 17.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.768 0.318 . . . . 0.0 110.914 -178.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -124.8 156.3 38.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.835 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' CB ' ' HA ' ' A' ' 10' ' ' LYS . . . -71.88 127.91 34.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.817 0.341 . . . . 0.0 110.599 176.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.9 -4.04 78.1 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.234 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 56.8 t -110.99 108.54 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.778 0.323 . . . . 0.0 110.58 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.8 m -78.34 114.65 17.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.538 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.565 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 42.9 mt-30 -117.36 143.99 45.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 0.0 110.988 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.9 m -72.1 131.29 42.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.861 -175.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 m -136.99 154.98 76.46 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.515 ' HD2' HD12 ' A' ' 31' ' ' LEU . 12.9 Cg_exo -71.05 163.6 38.66 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 111.603 174.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -63.04 -26.78 69.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.465 -176.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -67.67 -36.26 80.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.715 0.293 . . . . 0.0 110.923 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.515 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.0 mt -81.1 -31.15 34.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 177.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 56.7 t80 -60.19 -40.56 90.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.565 174.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -71.16 -43.62 67.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.435 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.23 -40.98 87.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.52 -14.81 51.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.939 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -69.01 -28.8 66.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -86.04 1.76 49.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.087 175.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -121.49 94.49 48.55 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 110.475 -173.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.62 61.89 7.0 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 114.976 -168.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.481 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 1.0 OUTLIER -153.22 25.3 0.54 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.261 0.553 . . . . 0.0 110.34 166.571 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -123.98 139.98 53.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.389 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.524 HG13 HD11 ' A' ' 7' ' ' ILE . 11.8 mt -97.2 115.08 35.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 162.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.524 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 32.6 mt -99.75 110.14 22.54 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.218 -174.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.4 m -110.59 123.95 50.94 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.71 -175.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -90.03 114.08 25.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -101.23 144.1 30.5 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.526 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.4 mt -118.43 147.27 43.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.898 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -98.47 86.13 3.54 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.456 0.646 . . . . 0.0 110.52 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -98.58 -40.03 8.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.584 175.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.0 154.66 0.14 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.23 176.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -158.2 131.9 7.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.292 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 65.67 91.75 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.527 0.679 . . . . 0.0 109.327 -174.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.463 ' HB2' ' HD3' ' A' ' 54' ' ' PRO . 18.6 m-20 -98.8 -56.35 0.17 Allowed Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.076 -170.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 53' ' ' ASP . 80.5 Cg_endo -74.9 41.88 0.78 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.403 2.069 . . . . 0.0 114.246 -170.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.513 HG12 ' HG2' ' A' ' 97' ' ' GLN . 10.5 tp 179.87 29.98 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.017 0.913 . . . . 0.0 109.842 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -150.63 91.47 1.74 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.905 -173.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -142.74 153.47 43.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.672 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.574 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.6 m -62.44 143.1 57.48 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.688 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.86 -34.69 73.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -70.94 -28.78 64.74 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.615 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.574 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 14.2 mm-40 -71.98 -34.11 68.68 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.02 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.488 HD22 ' SD ' ' A' ' 65' ' ' MET . 95.8 mt -81.85 -20.4 39.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.253 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.688 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 32.0 mmtp -64.96 -28.13 69.31 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.076 0.465 . . . . 0.0 109.814 172.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.49 23.9 33.87 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.293 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.488 ' SD ' HD22 ' A' ' 62' ' ' LEU . 65.8 mtt -122.17 147.56 46.01 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.23 -176.37 4.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.832 0.348 . . . . 0.0 110.808 -178.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.445 ' HZ1' ' CD ' ' A' ' 71' ' ' GLU . 58.5 tttm -52.16 -44.14 64.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.195 -176.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.23 89.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.803 -174.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.462 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.7 OUTLIER -61.84 -50.02 73.96 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.702 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.512 ' O ' HG13 ' A' ' 74' ' ' ILE . 91.2 m-70 -50.56 -46.12 57.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.186 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.473 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 43.1 mt-10 -64.67 -51.27 63.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.74 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.7 t -57.16 -50.11 73.85 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.301 0.376 . . . . 0.0 111.436 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.1 mt -52.84 -61.07 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.638 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.72 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 2.1 mt -77.36 -18.87 14.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.509 -170.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.0 m -69.14 -31.03 69.42 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -72.55 -32.45 66.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.306 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.453 HD23 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -66.39 -38.82 88.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.39 173.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.1 -69.72 0.46 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.083 -0.58 . . . . 0.0 111.816 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.435 ' O ' HG22 ' A' ' 74' ' ' ILE . 39.0 ttm180 -80.27 102.79 9.71 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.417 ' HB2' ' HD2' ' A' ' 81' ' ' PRO . 30.7 p-10 -71.22 155.42 93.07 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.178 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.72 ' HD3' ' HB ' ' A' ' 74' ' ' ILE . 60.0 Cg_endo -73.67 36.76 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.105 2.537 . . . . 0.0 113.91 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.4 t -79.75 -29.86 40.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -71.56 -38.98 70.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.809 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -88.4 108.68 19.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.833 -178.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -71.81 -63.08 1.2 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.228 -172.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -72.11 150.55 43.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.937 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.44 -37.21 80.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.559 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -60.22 -39.21 85.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.907 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -62.55 -38.66 90.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.304 0.573 . . . . 0.0 110.406 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 94' ' ' ILE . 34.4 mtt180 -68.76 -38.46 80.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.951 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.445 HG12 ' HE1' ' A' ' 70' ' ' HIS . 77.8 mt -65.24 -45.4 93.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.143 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.5 90.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.354 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.499 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.5 t80 -66.8 -36.77 83.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.823 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.1 mt -71.92 -46.09 61.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.389 . . . . 0.0 110.365 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.478 HD21 ' HA ' ' A' ' 59' ' ' GLU . 3.7 mm? -65.14 -45.55 84.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.745 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -79.4 -5.4 54.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.369 -0.533 . . . . 0.0 110.472 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.513 ' HG2' HG12 ' A' ' 55' ' ' ILE . 6.0 tp-100 -70.94 -31.9 68.63 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 41.6 mt -65.9 -26.76 39.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.635 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -78.2 -41.24 35.13 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.954 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -82.26 -42.65 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.594 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -88.0 -13.68 41.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.029 0.443 . . . . 0.0 110.68 -174.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.51 -104.09 1.23 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.807 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.02 96.3 6.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.602 0.239 . . . . 0.0 110.357 177.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 39.3 tp -77.8 -72.03 0.39 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 174.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 63.49 -178.46 0.15 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.752 175.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -116.98 -14.25 10.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.766 -175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.6 t60 -79.8 80.97 6.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.778 0.323 . . . . 0.0 110.748 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -179.72 66.01 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.102 173.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -128.53 14.57 6.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.661 0.744 . . . . 0.0 109.447 176.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -177.48 -36.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.971 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.981 175.677 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -129.01 104.2 7.44 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 67.9 p -108.69 143.6 37.58 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.359 -175.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.39 138.69 52.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.544 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.634 ' HD3' ' HG ' ' A' ' 24' ' ' SER . 28.1 ttpp -141.28 134.74 29.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.584 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 21' ' ' ALA . 3.8 mm? -61.64 123.91 19.22 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.814 0.34 . . . . 0.0 110.646 176.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.518 HG13 ' HD2' ' A' ' 8' ' ' LYS . 13.5 pt -100.65 -23.01 4.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.014 173.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.518 ' HD2' HG13 ' A' ' 7' ' ' ILE . 2.0 mptp? -132.6 122.31 24.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.099 171.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.82 -137.44 8.68 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.218 -0.991 . . . . 0.0 112.888 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.778 ' HG3' ' H ' ' A' ' 11' ' ' THR . 49.6 pttt -168.01 -68.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.778 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.6 p -132.14 118.38 19.53 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -129.77 111.74 12.93 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.511 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 45.3 t-20 -95.92 120.03 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.225 -177.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.47 HG22 HD21 ' A' ' 35' ' ' LEU . 50.5 t -119.13 104.49 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 0.0 110.682 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.2 mtt 62.95 20.14 12.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.124 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.11 -30.19 5.73 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.379 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.29 116.34 30.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.8 m -96.58 108.81 21.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 -177.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -90.08 144.6 25.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.497 ' HG3' HG23 ' A' ' 11' ' ' THR . 10.1 mpt_? -117.06 149.13 40.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.561 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' A' ' 6' ' ' LEU . . . -63.31 109.82 1.7 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.588 176.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.65 -1.78 39.27 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.193 -178.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.7 t -117.47 125.54 74.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.76 0.314 . . . . 0.0 110.516 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.634 ' HG ' ' HD3' ' A' ' 5' ' ' LYS . 19.4 m -100.04 123.49 44.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.518 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -118.79 150.69 39.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.71 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -92.78 126.65 37.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.213 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.9 m -124.46 157.42 65.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.195 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.528 ' HD2' HD11 ' A' ' 31' ' ' LEU . 38.3 Cg_exo -62.21 156.91 47.72 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.936 2.424 . . . . 0.0 110.974 171.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.576 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -68.08 -15.85 63.77 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -172.772 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -71.65 -43.03 66.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.423 . . . . 0.0 110.026 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.528 HD11 ' HD2' ' A' ' 28' ' ' PRO . 38.0 mt -73.74 -33.69 64.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.902 175.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.576 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 84.4 t80 -53.65 -53.95 44.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.708 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 37' ' ' GLU . 4.2 mm-40 -65.94 -36.7 84.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.581 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -62.45 -45.84 91.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 110.276 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.47 HD21 HG22 ' A' ' 14' ' ' VAL . 95.5 mt -74.08 -25.9 60.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.037 0.446 . . . . 0.0 110.602 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.02 -26.31 68.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.093 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 41.8 mt-10 -77.82 -11.29 59.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.319 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.406 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 35.4 m-80 -102.38 113.81 65.7 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.93 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 19.1 Cg_exo -66.85 -7.39 18.3 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 123.184 2.589 . . . . 0.0 114.546 -173.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -101.62 17.0 23.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.416 -0.513 . . . . 0.0 111.917 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -119.33 131.68 55.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.457 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.509 ' HB ' HG21 ' A' ' 7' ' ' ILE . 14.0 tt -97.19 117.39 41.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.685 0.755 . . . . 0.0 108.998 166.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.451 ' HA ' ' O ' ' A' ' 3' ' ' THR . 4.9 mp -107.07 115.59 30.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.828 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.3 m -104.68 124.74 49.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.368 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -101.92 104.46 15.17 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.43 114.2 27.99 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.033 0.444 . . . . 0.0 110.311 178.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.27 138.62 57.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.97 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -63.33 -31.05 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -131.26 123.46 28.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.092 172.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.458 HE22 ' HA ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -116.53 166.04 12.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.267 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -102.33 12.51 36.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.784 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.458 ' HA ' HE22 ' A' ' 50' ' ' GLN . 20.7 t0 57.51 90.89 0.04 OUTLIER 'General case' 0 C--O 1.233 0.227 0 O-C-N 123.746 0.654 . . . . 0.0 110.814 -178.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -66.97 113.14 11.92 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.048 -175.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.476 ' O ' HG21 ' A' ' 55' ' ' ILE . 96.1 Cg_endo -80.19 161.82 23.08 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.866 2.377 . . . . 0.0 112.387 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.694 HG12 HD23 ' A' ' 77' ' ' LEU . 7.0 tp 52.45 24.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 124.142 0.977 . . . . 0.0 111.766 178.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.526 ' OD1' HG12 ' A' ' 98' ' ' ILE . 7.9 t30 -153.1 83.51 1.2 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.128 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.24 152.45 50.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.113 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.726 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 24.3 m -57.23 138.27 54.9 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.375 0.422 . . . . 0.0 110.247 172.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 1.3 pt-20 -58.78 -30.43 67.55 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.634 ' H ' HG21 ' A' ' 58' ' ' THR . 15.1 m -69.2 -26.95 65.08 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.242 175.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.726 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 8.5 mm-40 -79.19 -44.49 21.78 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-O 121.061 0.458 . . . . 0.0 110.19 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.9 mt -70.77 -20.63 62.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.455 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -65.12 -36.02 82.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.887 -177.195 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.08 42.16 1.96 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.719 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 65.6 mtt -117.53 166.37 12.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.032 0.444 . . . . 0.0 110.996 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.555 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 36.3 m-80 -83.51 162.36 20.93 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.293 174.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -67.21 -38.49 85.39 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.421 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.38 73.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.555 ' HG3' ' HB2' ' A' ' 66' ' ' ASN . 41.7 mt-10 -63.99 -49.89 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.467 ' O ' HG13 ' A' ' 74' ' ' ILE . 34.4 m-70 -54.51 -44.46 72.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.022 173.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.513 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.3 mt-10 -57.81 -44.39 86.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.736 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.6 m -64.94 -45.56 85.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.945 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.0 mt -56.94 -59.71 2.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.347 0.594 . . . . 0.0 111.466 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 70' ' ' HIS . 5.2 mt -73.04 -21.49 19.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.036 -172.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.0 t -66.37 -36.46 82.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 175.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -69.51 -31.94 70.48 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.001 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.694 HD23 HG12 ' A' ' 55' ' ' ILE . 31.6 tp -63.1 -38.03 89.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.376 173.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.38 28.23 2.86 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.948 -177.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.502 ' HD2' ' OH ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -150.49 102.64 3.06 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 177.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -75.0 116.64 56.03 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.227 0.537 . . . . 0.0 110.269 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.513 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 96.0 Cg_endo -79.61 29.52 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 123.067 2.512 . . . . 0.0 112.738 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.96 -17.57 64.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.04 -27.25 30.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -82.43 109.05 16.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.733 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' HB3' ' HZ3' ' A' ' 85' ' ' LYS . 3.2 mmmp? -71.73 -40.29 69.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.809 -174.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.522 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 19.2 m-80 -91.88 166.99 12.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.95 0.405 . . . . 0.0 110.148 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -85.77 -22.7 27.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.759 -178.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -63.0 -49.07 76.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.202 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.522 ' OE1' ' HB2' ' A' ' 86' ' ' ASN . 2.0 mp0 -58.57 -35.33 72.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.096 0.474 . . . . 0.0 110.615 177.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.477 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.0 mtt180 -66.14 -38.61 88.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.042 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 87' ' ' ALA . 77.0 mt -66.85 -45.06 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.008 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.23 99.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.427 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.502 ' OH ' ' HD2' ' A' ' 79' ' ' ARG . 64.3 t80 -65.95 -36.81 84.36 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.899 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 90' ' ' ARG . 77.5 mt -66.88 -36.4 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.147 177.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.473 HD23 HD13 ' A' ' 98' ' ' ILE . 85.4 mt -62.57 -28.07 69.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.749 174.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.15 -30.41 71.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.548 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.67 -31.76 57.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.478 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.526 HG12 ' OD1' ' A' ' 56' ' ' ASN . 45.0 mt -66.2 -34.66 71.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.633 0.73 . . . . 0.0 109.805 174.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -63.83 -29.47 70.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.407 177.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -86.43 -54.21 4.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.792 178.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -102.01 99.87 10.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.456 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 147.88 -61.23 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -162.54 91.52 0.76 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.912 0.387 . . . . 0.0 110.769 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 pp -88.71 -26.9 21.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.56 0.695 . . . . 0.0 109.524 173.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -102.73 100.01 10.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -63.46 121.21 13.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 0.0 111.541 -172.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -93.86 158.83 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 11.8 p80 -92.2 68.54 5.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.994 0.902 . . . . 0.0 109.456 173.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -115.61 -48.82 2.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.383 -1.28 . . . . 0.0 109.642 -176.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -90.8 -29.09 17.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.581 174.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.352 -0.833 . . . . 0.0 109.735 -179.749 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.56 ' HB3' ' HB2' ' A' ' 46' ' ' GLU . 65.6 mtt . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 121.163 0.506 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.545 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 63.8 m-85 -123.52 114.26 19.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.242 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.9 p -111.09 122.88 49.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.01 0.433 . . . . 0.0 110.954 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.21 127.64 54.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.351 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -121.22 118.33 29.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.834 0.35 . . . . 0.0 110.724 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -66.92 126.84 30.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.525 HD13 HG13 ' A' ' 42' ' ' ILE . 26.4 pt -116.99 -33.06 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.862 0.363 . . . . 0.0 111.959 -175.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.441 ' N ' HG13 ' A' ' 7' ' ' ILE . 61.2 tttp -111.97 102.52 10.74 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -176.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.86 -119.0 1.47 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.411 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -176.5 -65.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -173.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 m -137.78 123.21 19.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.7 177.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -127.64 146.82 50.42 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -175.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -119.44 117.26 27.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.606 0.241 . . . . 0.0 110.544 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -115.23 101.39 12.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.6 mtt 62.73 -86.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.31 178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.67 9.15 6.13 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.272 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.4 HD13 ' N ' ' A' ' 17' ' ' ILE . 4.4 mp -118.96 126.45 75.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.1 m -99.11 128.22 45.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.4 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -109.86 139.13 45.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.47 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.5 mtm-85 -116.49 142.43 46.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.459 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.17 117.3 3.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 111.623 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.87 0.34 55.12 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.765 -0.731 . . . . 0.0 113.045 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -109.55 116.44 52.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 111.005 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.6 m -83.2 106.75 15.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.728 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -109.84 139.42 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.525 -176.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -71.99 120.27 17.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.003 0.43 . . . . 0.0 110.533 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.8 m -112.98 158.32 38.16 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.339 -175.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.514 ' HD2' HD13 ' A' ' 31' ' ' LEU . 34.0 Cg_exo -62.37 150.68 86.36 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.624 2.216 . . . . 0.0 111.293 172.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -59.12 -29.99 67.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.425 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.84 -44.6 85.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 0.0 110.693 176.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.514 HD13 ' HD2' ' A' ' 28' ' ' PRO . 62.6 mt -76.07 -20.76 57.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.297 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.545 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 73.8 t80 -60.8 -47.86 84.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.895 0.379 . . . . 0.0 110.06 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -73.19 -35.36 66.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.058 0.456 . . . . 0.0 110.024 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.5 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 83.3 t80 -59.92 -29.83 68.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.746 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.4 mt -94.66 -16.26 23.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.003 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.32 -29.79 67.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.637 0.732 . . . . 0.0 109.821 177.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -90.6 7.46 39.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.253 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -115.18 106.64 50.92 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.611 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -76.58 40.67 0.8 Allowed 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.561 2.84 . . . . 0.0 115.337 -165.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.44 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 2.1 p90 -149.01 25.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 173.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.457 ' CZ ' HD21 ' A' ' 6' ' ' LEU . 61.6 m-85 -127.06 138.61 53.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.226 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.525 HG13 HD13 ' A' ' 7' ' ' ILE . 46.8 mt -96.67 113.29 30.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 18.4 mt -100.32 107.79 19.67 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.763 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 p -102.87 115.06 29.86 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.652 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -90.29 135.92 33.38 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.56 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 37.3 mt-10 -101.42 108.86 20.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.205 0.526 . . . . 0.0 109.739 -175.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 75.0 mt -107.29 96.26 6.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.192 -174.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -97.24 73.53 2.48 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.76 -65.29 1.03 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.073 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -142.67 131.03 22.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.913 ' HD3' ' HB2' ' A' ' 52' ' ' ASP . 13.9 tmtt? -163.49 135.07 4.87 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.929 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.913 ' HB2' ' HD3' ' A' ' 51' ' ' LYS . 2.6 t70 78.44 136.26 0.06 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 124.176 0.922 . . . . 0.0 112.321 171.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -103.74 105.19 46.6 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 173.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.75 38.22 0.45 Allowed 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 123.403 2.735 . . . . 0.0 114.033 -171.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.65 HG12 HD13 ' A' ' 77' ' ' LEU . 10.2 tp -174.81 30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.899 0.856 . . . . 0.0 109.314 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -159.0 94.72 1.23 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.996 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -138.08 157.0 47.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.839 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.903 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.5 m -63.77 134.09 54.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 173.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 13.0 pt-20 -59.42 -33.45 71.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 p -69.22 -30.0 68.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.24 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.903 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 59.3 mm-40 -73.17 -37.25 66.61 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.635 176.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.548 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 97.6 mt -77.48 -15.34 59.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.581 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 27.4 mmtp -70.79 -37.24 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.753 0.311 . . . . 0.0 111.06 176.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.4 39.3 3.0 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.555 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 64.4 mtt -137.21 172.82 12.43 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.78 -157.51 0.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -68.62 -42.22 78.39 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.588 -175.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.62 62.78 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.488 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.8 mp0 -52.35 -55.88 18.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.971 0.415 . . . . 0.0 110.392 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.588 ' HE1' HG12 ' A' ' 91' ' ' ILE . 28.0 m-70 -58.96 -44.6 91.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.831 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 63.5 mt-10 -63.63 -41.46 98.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.772 -0.195 . . . . 0.0 111.108 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.1 p -65.34 -34.62 78.75 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.521 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.506 HD11 ' HA ' ' A' ' 70' ' ' HIS . 96.6 mt -58.81 -57.59 10.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.962 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.58 HG13 ' O ' ' A' ' 70' ' ' HIS . 1.3 mt -72.55 -16.1 17.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.862 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 66.7 m -67.9 -36.51 80.33 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -66.44 -34.52 78.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.007 173.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.65 HD13 HG12 ' A' ' 55' ' ' ILE . 46.3 tp -63.59 -38.37 90.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.008 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 104.06 23.8 7.96 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.083 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.466 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 0.1 OUTLIER -131.66 126.23 34.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.727 0.298 . . . . 0.0 110.269 -178.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -73.89 136.51 76.77 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.888 178.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.474 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 5.0 Cg_exo -80.23 49.46 3.21 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.082 2.521 . . . . 0.0 111.329 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -49.75 -54.29 19.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.153 -170.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -106.27 24.73 12.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.338 0.589 . . . . 0.0 110.964 -174.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -107.61 120.27 41.76 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.462 ' HG2' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -115.56 -32.86 5.41 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.918 -175.02 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.58 169.59 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.543 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -72.98 -41.26 64.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.671 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.19 -44.8 88.23 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.632 0.582 . . . . 0.0 111.628 -177.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.462 ' OE1' ' HG2' ' A' ' 85' ' ' LYS . 33.3 mt-10 -58.09 -38.78 77.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 110.55 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.517 ' HD3' ' HB2' ' A' ' 70' ' ' HIS . 73.0 mtt85 -72.81 -32.04 65.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.711 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.588 HG12 ' HE1' ' A' ' 70' ' ' HIS . 75.8 mt -67.49 -47.15 81.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.15 -44.77 75.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.189 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.466 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 37.0 t80 -65.05 -40.51 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.92 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.484 ' O ' HG13 ' A' ' 98' ' ' ILE . 86.9 mt -67.52 -44.31 86.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.425 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.451 HD11 HD12 ' A' ' 98' ' ' ILE . 3.7 mm? -62.61 -41.37 98.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.292 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -65.32 -28.0 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 110.991 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -19.4 46.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.915 0.388 . . . . 0.0 110.39 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 94' ' ' ILE . 75.9 mt -74.27 -42.2 50.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 172.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.8 -48.74 70.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.28 176.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -89.77 32.45 0.89 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.798 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -66.53 -34.91 78.97 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 97.26 -107.6 3.52 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.193 172.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 68.03 84.02 0.16 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.505 0.722 . . . . 0.0 112.201 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -111.3 122.89 49.03 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.14 120.36 23.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.648 0.737 . . . . 0.0 111.349 -176.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -90.98 16.8 8.84 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.364 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -87.84 -26.41 22.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.595 -173.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.7 p-80 -82.56 114.26 20.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.375 0.607 . . . . 0.0 110.378 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -90.38 -16.44 29.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.899 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -87.92 138.04 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.295 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.8 p80 . . . . . 0 C--O 1.244 0.764 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.421 175.659 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.303 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -95.87 108.09 20.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.615 ' HB ' ' HB ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -116.28 134.86 54.44 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -170.037 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.65 118.66 28.66 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 174.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 38.9 ttpt -119.11 126.4 51.54 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.835 0.35 . . . . 0.0 110.332 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.631 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -66.02 125.33 25.12 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.403 HG13 ' HG3' ' A' ' 8' ' ' LYS . 29.3 pt -111.9 -30.91 2.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.267 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HG3' HG13 ' A' ' 7' ' ' ILE . 64.2 mttp -127.89 111.53 13.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.781 0.324 . . . . 0.0 110.726 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.47 -13.29 3.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.658 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.459 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 61.5 mttp 71.39 -51.02 0.69 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.496 0.719 . . . . 0.0 111.922 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -150.35 129.45 12.69 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.741 0.305 . . . . 0.0 110.349 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -156.77 129.71 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -111.19 146.15 37.4 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.913 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.433 HG21 HD22 ' A' ' 35' ' ' LEU . 44.6 t -127.93 99.25 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.274 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 61.9 mtm 57.74 49.55 12.1 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.855 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.49 -35.58 4.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.603 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.473 HD13 HD12 ' A' ' 31' ' ' LEU . 4.0 mp -80.24 108.76 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.2 m -91.44 126.77 36.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.017 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.48 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 71.7 m-85 -108.03 146.04 33.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.81 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -133.87 154.88 50.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.688 0.28 . . . . 0.0 110.972 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.631 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -60.76 105.34 0.44 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.081 178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.74 11.17 47.89 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.688 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.67 108.21 24.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.887 0.375 . . . . 0.0 110.632 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.419 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 15.2 m -74.95 122.13 22.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.592 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -121.51 129.13 52.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.504 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.5 p -74.42 129.91 38.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.732 0.301 . . . . 0.0 110.351 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -120.73 153.4 56.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.468 -174.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.51 ' HD2' HD11 ' A' ' 31' ' ' LEU . 19.5 Cg_exo -67.12 164.99 28.03 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.714 2.276 . . . . 0.0 111.167 171.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.41 -29.99 70.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.858 0.361 . . . . 0.0 110.938 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -64.72 -50.16 68.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.713 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.51 HD11 ' HD2' ' A' ' 28' ' ' PRO . 45.2 mt -71.72 -29.41 64.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.503 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.497 ' HH ' ' CD ' ' A' ' 45' ' ' GLN . 55.3 t80 -55.44 -51.36 67.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.523 176.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 44.8 mt-10 -75.42 -31.25 60.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.98 0.419 . . . . 0.0 110.776 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -61.46 -33.36 73.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.303 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.529 HD21 ' CE1' ' A' ' 41' ' ' PHE . 93.2 mt -98.69 -12.61 20.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.982 177.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.452 ' HB3' ' HA ' ' A' ' 33' ' ' GLU . 5.8 t30 -61.22 -36.16 79.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.565 0.698 . . . . 0.0 109.882 173.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -87.12 13.41 9.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.266 176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -116.58 122.96 31.07 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.792 0.329 . . . . 0.0 110.352 177.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -88.64 22.42 0.86 Allowed 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.992 2.461 . . . . 0.0 114.101 -174.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -127.58 21.49 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.188 0.518 . . . . 0.0 111.669 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.529 ' CE1' HD21 ' A' ' 35' ' ' LEU . 73.9 m-85 -128.49 145.49 51.09 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.9 tt -97.33 124.32 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 171.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 36' ' ' ASN . 12.5 mt -100.84 108.37 20.15 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.141 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.615 ' HB ' ' HB ' ' A' ' 3' ' ' THR . 20.8 m -101.11 106.84 18.14 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.818 -174.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.497 ' CD ' ' HH ' ' A' ' 32' ' ' TYR . 10.6 mt-30 -107.97 110.32 22.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.224 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -101.64 104.87 15.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.825 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 56.3 tp -120.01 95.89 4.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.965 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.06 92.3 3.67 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.3 0.571 . . . . 0.0 110.181 177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -85.1 93.83 8.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.208 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -113.94 -6.84 13.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.95 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -128.73 94.53 3.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.19 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -141.99 1.73 1.48 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -89.69 126.85 56.5 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.347 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.44 ' O ' HG21 ' A' ' 55' ' ' ILE . 20.0 Cg_exo -66.58 -177.1 0.82 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.858 2.372 . . . . 0.0 111.754 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.778 HG12 HD21 ' A' ' 77' ' ' LEU . 10.8 tp 49.02 25.61 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-O 121.915 0.864 . . . . 0.0 111.458 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -141.62 96.46 2.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.819 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.44 ' HB2' HD13 ' A' ' 62' ' ' LEU . 83.8 m-85 -140.6 161.91 36.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.709 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.642 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 1.1 m -61.88 133.58 55.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.484 ' HG3' ' N ' ' A' ' 60' ' ' SER . 0.6 OUTLIER -66.5 -32.95 74.63 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.969 -0.693 . . . . 0.0 109.706 -179.115 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.484 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 10.8 m -69.73 -24.83 63.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.223 0.535 . . . . 0.0 109.819 174.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.642 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 59.4 tt0 -81.66 -35.52 29.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.849 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.44 HD13 ' HB2' ' A' ' 57' ' ' TYR . 96.3 mt -83.06 -6.32 59.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.718 175.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HD2' HD11 ' A' ' 91' ' ' ILE . 15.5 tptt -66.25 -27.1 67.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.626 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.21 -119.01 4.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 173.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.2 mmt 59.74 -158.17 0.32 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.423 0.63 . . . . 0.0 111.927 174.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.741 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 42.9 t-20 -123.64 158.66 31.03 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.96 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -67.27 -36.36 81.4 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 71' ' ' GLU . . . -61.85 -32.77 73.14 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.131 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.741 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 12.5 mm-40 -62.66 -56.67 15.62 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.663 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.8 m80 -51.45 -40.61 59.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.963 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 45.1 mm-40 -51.84 -64.99 0.64 Allowed 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.302 0.376 . . . . 0.0 110.549 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.8 m -56.91 -44.47 82.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.216 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.2 mt -53.28 -57.22 5.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.648 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.663 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.2 mt -82.05 -20.96 10.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.753 -172.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.51 -33.38 74.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -73.38 -27.76 61.65 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.778 HD21 HG12 ' A' ' 55' ' ' ILE . 56.7 tp -65.89 -29.75 70.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.97 0.414 . . . . 0.0 110.173 172.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.84 9.38 26.56 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.466 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -133.47 97.82 4.05 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 14.5 m120 -68.42 131.8 91.59 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.698 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 80' ' ' ASN . 57.1 Cg_endo -88.92 65.39 2.75 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.924 2.416 . . . . 0.0 112.379 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.1 t -86.36 -31.7 21.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.471 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -90.05 -25.01 21.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.937 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -82.32 108.65 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -92.69 -61.92 1.5 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.52 -168.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -72.81 163.72 27.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.04 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.517 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -63.64 -45.73 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.52 -174.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.512 ' HA ' HD12 ' A' ' 91' ' ' ILE . 10.3 t70 -65.97 -32.27 73.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.077 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.37 -44.0 96.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.544 0.688 . . . . 0.0 110.074 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -68.57 -34.83 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.24 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 87' ' ' ALA . 86.3 mt -65.8 -41.51 90.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.12 176.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.34 83.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.71 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -63.33 -44.76 93.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.623 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.487 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.0 mt -61.33 -45.56 98.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.206 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -47.95 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.562 -177.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.0 mttp -67.13 -20.87 65.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -80.16 -40.49 27.2 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 94' ' ' ILE . 83.4 mt -63.74 -35.32 72.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.456 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -60.15 -33.64 72.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.199 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -64.44 -34.29 77.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.32 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -91.57 18.88 6.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.357 178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.1 -45.79 47.77 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.23 -0.51 . . . . 0.0 112.751 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -113.89 141.48 47.3 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.424 ' C ' ' H ' ' A' ' 106' ' ' HIS . 92.2 mt 53.17 64.09 1.99 Allowed 'General case' 0 C--O 1.235 0.333 0 O-C-N 123.7 0.625 . . . . 0.0 110.473 -176.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.34 28.54 0.31 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.21 -176.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.424 ' H ' ' C ' ' A' ' 104' ' ' LEU . 16.4 p80 41.88 88.82 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.136 0.974 . . . . 0.0 113.028 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -64.22 -26.59 68.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.042 177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -120.21 105.16 10.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.727 174.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -83.79 4.37 29.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.568 -177.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.9 t-160 71.78 100.22 0.07 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.182 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.6 t60 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.632 -177.625 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.8 mtp . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.57 129.41 50.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.629 ' OG1' ' HB ' ' A' ' 44' ' ' THR . 73.9 p -131.59 155.48 47.44 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.686 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -126.84 137.8 53.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.224 177.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' HB2' ' OG ' ' A' ' 24' ' ' SER . 5.8 ttpm? -120.73 116.97 26.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.104 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.589 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -67.99 124.28 22.95 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.564 HG13 ' N ' ' A' ' 8' ' ' LYS . 18.9 pt -117.61 -36.67 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.909 0.385 . . . . 0.0 111.695 -177.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.564 ' N ' HG13 ' A' ' 7' ' ' ILE . 44.9 tttm -92.06 30.56 1.4 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.747 -167.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.1 -126.7 0.85 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.62 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.436 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 9.2 ptpp? -160.13 -44.45 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.7 m -152.99 125.01 7.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.989 174.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -140.01 117.55 11.49 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -91.22 115.87 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.3 t -106.38 97.29 5.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.726 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 62.8 mtt 59.39 22.65 11.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.931 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 121.6 -33.75 4.18 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.578 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.9 mm -78.32 108.79 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.3 m -91.06 101.22 13.97 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.702 0.286 . . . . 0.0 110.759 -175.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 98.4 m-85 -86.06 144.37 27.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.587 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -124.97 143.26 50.98 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -51.71 118.27 3.26 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.67 4.03 59.33 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.768 -0.651 . . . . 0.0 113.224 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.5 t -117.75 112.1 37.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 117.024 0.412 . . . . 0.0 111.523 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 71.5 m -74.45 116.47 15.16 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.896 171.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.492 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 25.6 mt-30 -116.3 146.78 42.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.498 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.519 ' HA ' HG23 ' A' ' 3' ' ' THR . 13.0 p -67.51 131.81 46.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.127 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 35.6 m -134.7 144.83 52.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.922 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.525 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.7 Cg_exo -66.96 161.77 41.0 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.627 2.218 . . . . 0.0 110.883 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -59.02 -31.53 68.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.613 0.245 . . . . 0.0 111.469 -176.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.51 -48.49 79.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.862 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.525 HD12 ' HD2' ' A' ' 28' ' ' PRO . 68.9 mt -73.4 -29.01 62.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.667 0.27 . . . . 0.0 110.537 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -55.6 -48.95 74.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.962 174.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -71.56 -34.87 70.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.309 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 66.8 t80 -64.94 -40.84 95.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.595 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.489 HD21 ' CE1' ' A' ' 41' ' ' PHE . 73.6 mt -81.93 -20.13 39.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.741 0.305 . . . . 0.0 110.629 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -66.32 -26.05 67.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.679 0.752 . . . . 0.0 109.051 169.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 34' ' ' TYR . 13.7 tp10 -79.4 -15.42 57.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.929 176.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.478 ' HB3' ' CD2' ' A' ' 40' ' ' TYR . 40.4 m-80 -115.14 113.18 43.85 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.532 -174.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 2.8 Cg_exo -75.32 41.34 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.016 2.477 . . . . 0.0 114.105 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.478 ' CD2' ' HB3' ' A' ' 38' ' ' ASN . 9.1 m-85 -111.75 -6.26 14.34 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.926 0.393 . . . . 0.0 110.001 176.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.489 ' CE1' HD21 ' A' ' 35' ' ' LEU . 78.7 m-85 -124.41 141.79 51.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.783 -169.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.495 HG13 HD13 ' A' ' 7' ' ' ILE . 68.9 mt -110.57 111.25 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 164.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 6.3 mp -82.91 148.52 27.63 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 120.955 0.407 . . . . 0.0 111.193 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.629 ' HB ' ' OG1' ' A' ' 3' ' ' THR . 17.7 m -116.53 107.33 14.62 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.675 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -94.38 112.61 24.4 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -104.81 115.64 30.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.151 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.3 tt -91.12 114.03 26.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -79.48 102.22 8.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.372 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -76.54 110.26 10.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.077 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -112.19 79.56 1.23 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -102.87 -11.79 18.01 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.172 0.511 . . . . 0.0 110.167 -175.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -73.23 117.69 15.28 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.757 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 56.37 84.26 0.21 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.409 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.462 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 2.7 Cg_exo -76.74 96.36 1.09 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.362 2.708 . . . . 0.0 112.606 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.448 HG12 HD12 ' A' ' 77' ' ' LEU . 10.4 tp -171.33 21.2 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 122.46 1.124 . . . . 0.0 108.998 174.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.461 ' HA ' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -153.29 100.17 2.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.901 -175.071 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.403 ' HB2' HD11 ' A' ' 62' ' ' LEU . 90.9 m-85 -142.66 177.83 8.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.316 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.637 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -76.76 133.37 39.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.928 177.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.423 ' O ' ' HE2' ' A' ' 63' ' ' LYS . 4.2 pt-20 -66.97 -33.01 74.65 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.46 -178.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 11.5 p -74.28 -22.71 59.17 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.863 ' HG2' ' HE1' ' A' ' 65' ' ' MET . 53.9 tt0 -80.19 -40.58 26.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.452 176.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 81.0 mt -75.85 -9.98 59.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.746 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 59' ' ' GLU . 7.6 tppt? -66.39 -19.84 65.91 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.13 -113.23 2.11 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.52 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.863 ' HE1' ' HG2' ' A' ' 61' ' ' GLU . 47.7 mtt 62.13 -175.4 0.14 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.53 0.681 . . . . 0.0 111.562 -177.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.66 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 46.4 t30 -95.49 151.41 19.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.279 174.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.508 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 51.8 mtmt -54.1 -48.24 70.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.805 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.4 -30.39 64.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.088 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.66 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 7.0 mm-40 -63.67 -52.02 62.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.441 ' HE1' ' O ' ' A' ' 62' ' ' LEU . 77.7 m-70 -55.79 -44.21 77.57 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.49 -43.45 97.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.611 -177.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -64.19 -40.61 96.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.757 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.4 mt -51.99 -62.15 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.13 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.4 OUTLIER -76.45 -16.93 15.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.935 -174.035 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.0 t -66.34 -35.2 79.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -32.02 60.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.353 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.448 HD12 HG12 ' A' ' 55' ' ' ILE . 47.1 tp -63.51 -36.21 83.03 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.151 0.5 . . . . 0.0 110.404 174.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.9 5.3 33.41 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.112 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.13 119.5 39.48 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -63.07 122.57 75.99 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.053 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.72 -3.33 11.76 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.189 2.592 . . . . 0.0 111.926 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.0 m -68.34 -12.2 60.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.965 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.97 -34.37 71.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.188 0.518 . . . . 0.0 110.559 175.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.601 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . 57.8 m-85 -100.23 122.75 43.53 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.95 -171.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -82.33 -40.19 21.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.304 -178.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.837 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 94.6 m-20 -96.38 162.16 13.61 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.047 0.451 . . . . 0.0 111.597 -176.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.451 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -70.62 -36.08 73.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.54 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -63.92 -36.86 85.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.428 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.837 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 21.1 mm-40 -59.45 -40.37 86.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.368 0.604 . . . . 0.0 109.75 176.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.433 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.9 mtt85 -63.81 -49.14 74.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.619 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 87' ' ' ALA . 61.8 mt -60.08 -42.85 91.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.171 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.19 77.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.379 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -78.05 -41.15 36.42 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.519 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.55 ' O ' HG13 ' A' ' 98' ' ' ILE . 70.1 mt -62.49 -44.67 99.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.518 ' HA ' HD12 ' A' ' 98' ' ' ILE . 14.9 mt -62.23 -29.23 70.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.625 176.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HZ3' ' HB2' ' A' ' 96' ' ' LYS . 3.9 ttmp? -61.84 -42.37 98.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.775 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -81.1 -20.12 42.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.55 HG13 ' O ' ' A' ' 94' ' ' ILE . 96.6 mt -71.75 -44.27 68.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.127 0.489 . . . . 0.0 110.09 176.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -79.86 -46.11 17.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.372 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -109.3 91.92 3.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.133 0.492 . . . . 0.0 110.025 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.402 ' HB2' ' H ' ' A' ' 102' ' ' GLY . 11.0 pttm -103.5 -156.66 0.57 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.885 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' A' ' 101' ' ' LYS . . . -63.97 91.42 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 113.089 -176.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -86.74 -40.32 15.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.5 tt -95.06 96.18 9.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.046 176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.36 149.65 22.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.712 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -95.22 54.77 1.68 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 -176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.6 m80 69.98 120.93 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.257 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -73.2 132.35 43.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.693 -175.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -148.68 114.33 5.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.246 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 71.6 -44.66 0.6 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.686 0.794 . . . . 0.0 111.129 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.1 p80 . . . . . 0 C--O 1.245 0.853 0 CA-C-O 118.292 -0.861 . . . . 0.0 109.693 174.498 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.619 0.247 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 70.3 m-85 -81.68 142.71 32.45 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.877 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -131.69 135.47 46.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.026 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.17 122.51 47.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.183 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.518 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 88.6 tttt -109.01 107.23 17.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.421 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.621 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -65.84 122.3 17.01 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.524 HD13 HG13 ' A' ' 42' ' ' ILE . 43.2 pt -113.78 -24.14 3.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -178.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -102.59 105.16 15.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -176.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 116.58 -129.84 8.65 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.474 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 97.9 mttt -154.68 -46.18 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.9 p -136.21 153.82 51.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.645 172.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -162.41 116.45 1.79 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.757 0.313 . . . . 0.0 110.159 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.6 t-20 -90.76 112.31 24.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -178.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.472 HG13 HD23 ' A' ' 35' ' ' LEU . 54.9 t -104.2 108.69 25.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.793 177.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 65.41 -75.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.795 0.684 . . . . 0.0 111.364 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.85 6.19 1.81 Allowed Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.607 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 17' ' ' ILE . 4.2 mp -115.84 119.39 61.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 22.2 m -92.83 105.7 17.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.972 0.415 . . . . 0.0 110.585 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -84.64 161.82 19.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.414 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.423 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 62.6 mtt180 -133.66 136.99 45.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.446 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.621 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.29 109.49 0.55 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.817 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.17 -7.55 30.85 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.516 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.6 t -111.21 127.2 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -179.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.518 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 12.1 p -102.95 104.21 14.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.42 177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -102.02 149.83 23.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 0.0 110.819 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -73.52 132.74 43.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.814 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.8 m -126.9 155.35 75.69 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.328 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.508 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -64.26 151.93 83.39 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.692 2.261 . . . . 0.0 110.962 172.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -20.78 66.54 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -68.5 -45.86 71.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.354 0.597 . . . . 0.0 110.228 174.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.508 HD12 ' HD2' ' A' ' 28' ' ' PRO . 77.7 mt -75.18 -26.22 58.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.499 -179.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.469 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 84.9 t80 -57.32 -50.76 71.93 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.327 177.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 8.0 mm-40 -70.86 -33.43 70.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.131 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -62.31 -46.14 90.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 110.656 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.507 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.9 mt -79.24 -19.46 50.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.058 0.456 . . . . 0.0 110.344 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 32.7 t30 -62.97 -31.87 73.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.798 174.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.48 -1.12 55.22 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.877 176.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -123.48 117.72 27.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 111.682 -174.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.57 39.47 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 123.293 2.662 . . . . 0.0 113.851 -175.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.425 ' HB2' ' CD1' ' A' ' 41' ' ' PHE . 72.4 m-85 -98.38 -18.44 18.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.066 0.46 . . . . 0.0 110.208 176.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.507 ' CE1' HD22 ' A' ' 35' ' ' LEU . 68.3 m-85 -127.35 147.24 50.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.778 -169.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.524 HG13 HD13 ' A' ' 7' ' ' ILE . 60.0 mt -97.71 103.72 15.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 162.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.417 HD23 ' HB2' ' A' ' 35' ' ' LEU . 5.3 mp -87.06 131.24 34.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.608 -174.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.2 m -118.69 127.89 54.0 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.613 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -90.14 106.79 18.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.365 0.602 . . . . 0.0 109.417 175.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 49' ' ' ASN . 9.0 mm-40 -102.06 124.06 47.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.074 -174.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -95.44 109.48 21.66 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.251 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.6 t30 63.33 79.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.927 0.767 . . . . 0.0 110.386 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.569 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 25.2 p-10 -112.36 29.44 7.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.595 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -60.58 105.72 0.47 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.081 -178.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.733 ' HE2' ' HA ' ' A' ' 51' ' ' LYS . 0.5 OUTLIER -108.03 110.46 22.17 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.482 177.682 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -59.4 140.54 56.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.486 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -114.99 106.38 51.67 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.321 177.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -69.86 88.64 0.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.874 2.382 . . . . 0.0 111.154 177.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.662 HG22 HD13 ' A' ' 77' ' ' LEU . 11.2 tp -174.89 31.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 122.418 1.104 . . . . 0.0 108.397 -178.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -149.57 96.57 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.91 -173.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -142.72 165.67 26.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.537 -176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.6 m -64.9 129.81 41.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.353 175.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.4 pm0 -61.77 -38.59 88.59 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 179.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.8 m -62.26 -30.97 71.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -78.44 -35.0 47.46 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.348 0.594 . . . . 0.0 109.83 178.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.7 mt -77.64 -14.8 59.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.97 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 70.8 mmtt -66.06 -27.73 68.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.436 ' O ' ' HB3' ' A' ' 65' ' ' MET . . . -97.72 -148.52 23.96 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 169.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.454 ' HG3' ' OE1' ' A' ' 69' ' ' GLU . 43.6 ttm 68.75 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.106 0.479 . . . . 0.0 111.128 175.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -73.5 163.28 28.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.536 . . . . 0.0 111.153 -174.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -56.83 -41.41 77.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.156 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.36 90.87 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.221 0.326 . . . . 0.0 111.38 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.454 ' OE1' ' HG3' ' A' ' 65' ' ' MET . 47.7 mt-10 -60.1 -56.31 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.429 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.627 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.7 m-70 -51.11 -42.22 60.52 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.212 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.5 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 38.7 mt-10 -68.59 -41.52 79.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.748 -177.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 27.2 t -63.34 -41.64 98.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 69' ' ' GLU . 76.0 mt -52.95 -58.86 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.403 176.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.627 HG13 ' O ' ' A' ' 70' ' ' HIS . 7.2 mt -72.28 -24.25 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.528 -173.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.517 ' HA ' ' O ' ' A' ' 79' ' ' ARG . 49.9 m -74.94 -33.12 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.987 0.423 . . . . 0.0 110.008 175.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.1 -31.05 71.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.228 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.662 HD13 HG22 ' A' ' 55' ' ' ILE . 35.4 tp -61.62 -29.44 70.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.002 174.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 118.72 -7.07 13.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.934 -0.651 . . . . 0.0 111.507 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 mmt180 -90.49 -172.78 3.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.699 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 3.9 t-20 -150.8 109.29 3.09 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.68 178.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.5 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 5.2 Cg_exo -77.79 54.0 4.63 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 123.218 2.612 . . . . 0.0 112.896 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.0 p -83.61 -37.32 23.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.22 0.533 . . . . 0.0 110.568 177.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -93.94 7.32 45.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.447 0.641 . . . . 0.0 110.48 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -105.5 108.53 20.1 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -97.42 -45.05 6.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -171.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.544 ' HB2' ' HG3' ' A' ' 89' ' ' GLU . 39.2 m-80 -80.53 168.01 19.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.234 0.54 . . . . 0.0 111.541 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' ' 90' ' ' ARG . . . -81.05 -36.92 29.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.507 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.524 ' HA ' HD11 ' A' ' 91' ' ' ILE . 18.5 t70 -70.94 -32.77 69.75 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.863 -178.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.544 ' HG3' ' HB2' ' A' ' 86' ' ' ASN . 50.8 mt-10 -59.5 -46.33 89.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 110.748 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 18.2 ptp180 -71.3 -27.55 63.49 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.528 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.524 HD11 ' HA ' ' A' ' 88' ' ' ASP . 96.6 mt -65.43 -45.95 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.89 -42.81 80.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.769 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.411 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 42.3 t80 -68.22 -39.15 82.43 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.793 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.5 mt -66.04 -37.97 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.899 0.381 . . . . 0.0 110.283 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD21 HD13 ' A' ' 98' ' ' ILE . 13.3 mt -65.29 -37.5 87.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.402 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.9 tmtm? -59.06 -31.15 68.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.939 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.604 ' HG3' ' CG1' ' A' ' 55' ' ' ILE . 7.5 mm-40 -74.27 -30.94 62.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.487 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.488 HD13 HD21 ' A' ' 95' ' ' LEU . 56.0 mt -67.65 -28.16 40.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.373 177.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -69.05 -18.6 64.03 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.96 0.409 . . . . 0.0 110.538 176.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -81.64 0.32 39.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.524 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -97.24 138.78 34.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.307 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -95.94 -117.19 3.23 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.696 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -111.97 148.75 33.11 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -175.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.6 128.65 34.71 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 167.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -62.03 112.4 2.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.051 0.453 . . . . 0.0 111.443 -171.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.38 -23.87 17.6 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 t60 56.36 41.07 29.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.934 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -80.57 124.84 29.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.657 -170.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 110' ' ' HIS . 18.9 t-80 -146.1 -71.44 0.25 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.597 172.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 47.8 t60 174.58 131.92 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 123.71 0.632 . . . . 0.0 110.215 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.0 p80 . . . . . 0 C--O 1.243 0.76 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 172.955 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.851 ' HB3' ' HB2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.532 ' O ' ' HA ' ' A' ' 26' ' ' THR . 90.0 m-85 -117.18 110.35 18.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.189 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.405 HG23 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -106.79 131.7 53.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.789 -177.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.47 137.28 53.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.172 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -139.59 137.91 35.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.757 0.313 . . . . 0.0 111.08 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -65.11 118.58 9.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.653 174.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.572 HG21 ' HB ' ' A' ' 42' ' ' ILE . 36.3 pt -100.26 -6.34 9.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.502 0.667 . . . . 0.0 109.796 175.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.6 tttp -140.19 130.79 25.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.483 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 109.12 -132.82 11.29 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.315 -0.945 . . . . 0.0 112.42 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -164.32 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.618 0.247 . . . . 0.0 110.364 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.48 HG23 ' HG2' ' A' ' 20' ' ' ARG . 12.4 p -145.16 134.99 23.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.238 179.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -147.18 128.07 14.44 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -97.5 107.86 20.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.793 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.543 HG21 HD21 ' A' ' 35' ' ' LEU . 61.6 t -96.55 95.16 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.1 mtt 65.7 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.099 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -133.56 -1.87 3.73 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.938 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.475 ' N ' HD13 ' A' ' 17' ' ' ILE . 3.4 mp -102.06 113.81 39.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.5 m -87.99 116.55 26.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.733 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -98.59 151.09 21.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.735 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.48 ' HG2' HG23 ' A' ' 11' ' ' THR . 15.5 mtp180 -132.32 137.84 47.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 109.9 1.02 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.028 0.442 . . . . 0.0 111.037 177.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.2 -3.32 28.32 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.308 -178.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -118.81 113.84 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.831 0.348 . . . . 0.0 111.026 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.405 ' HB3' HG23 ' A' ' 3' ' ' THR . 33.6 m -85.09 126.05 33.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.262 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -129.17 151.48 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.37 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 1.2 p -80.92 138.59 36.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.855 0.359 . . . . 0.0 111.806 -176.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.9 153.4 81.7 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.959 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.468 ' HD2' HD11 ' A' ' 31' ' ' LEU . 7.6 Cg_exo -74.29 171.39 18.14 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 123.05 2.5 . . . . 0.0 112.264 175.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -51.9 -46.76 64.71 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.968 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.19 -45.34 94.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.411 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.468 HD11 ' HD2' ' A' ' 28' ' ' PRO . 62.8 mt -73.12 -28.93 62.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -58.44 -47.01 85.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -68.11 -41.29 81.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.575 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.98 -45.56 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.845 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.543 HD21 HG21 ' A' ' 14' ' ' VAL . 87.2 mt -76.83 -23.44 52.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.84 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.69 -29.59 70.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.362 0.601 . . . . 0.0 109.705 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -78.07 -6.69 55.41 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 38.1 m-80 -118.87 101.5 50.23 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.61 -177.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 14.2 Cg_exo -69.42 11.66 0.35 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.523 2.816 . . . . 0.0 114.735 -171.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.5 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 17.7 p90 -105.18 10.57 33.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.258 0.552 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.439 ' CE2' HD23 ' A' ' 35' ' ' LEU . 45.1 m-85 -117.07 136.29 53.09 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.885 172.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.572 ' HB ' HG21 ' A' ' 7' ' ' ILE . 9.9 tt -97.25 133.5 38.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 167.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mp -120.79 141.56 50.4 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.162 0.506 . . . . 0.0 110.554 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -130.15 116.45 18.47 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.586 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -99.2 113.47 25.75 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.513 0.673 . . . . 0.0 110.327 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 81.7 mt-10 -101.93 109.17 20.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.987 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.95 96.33 9.22 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -127.53 17.94 6.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.617 0.722 . . . . 0.0 109.598 -175.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -149.89 159.17 44.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.138 -177.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -81.41 149.33 28.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.979 0.418 . . . . 0.0 110.805 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -119.49 138.62 53.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.189 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.5 t70 51.91 87.91 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.598 0.561 . . . . 0.0 111.057 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.473 ' OD2' HG22 ' A' ' 55' ' ' ILE . 20.1 t70 -52.62 116.3 8.62 Favored Pre-proline 0 N--CA 1.469 0.509 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.183 -170.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 74.4 Cg_endo -95.11 89.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.299 2.666 . . . . 0.0 113.633 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.504 HG12 HD13 ' A' ' 77' ' ' LEU . 9.3 tp 179.66 26.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.968 0.89 . . . . 0.0 109.666 174.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.439 ' HB2' HG12 ' A' ' 98' ' ' ILE . 6.5 p30 -161.88 105.3 1.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.793 -175.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.504 ' HB2' ' HG ' ' A' ' 62' ' ' LEU . 68.5 m-85 -142.89 161.65 37.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.039 -177.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 60' ' ' SER . 13.9 m -60.43 142.97 54.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.595 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 2.5 pp20? -60.01 -36.95 78.32 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.418 ' H ' HG23 ' A' ' 58' ' ' THR . 6.5 m -67.53 -29.19 68.53 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.187 176.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.433 ' HG2' ' HE2' ' A' ' 65' ' ' MET . 33.5 tt0 -77.24 -34.51 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.88 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.504 ' HG ' ' HB2' ' A' ' 57' ' ' TYR . 87.5 mt -77.18 -21.24 54.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.11 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.595 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 29.4 mmtp -62.12 -40.24 95.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.906 172.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.82 47.68 2.5 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.155 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.474 ' SD ' HD22 ' A' ' 62' ' ' LEU . 65.9 mtt -141.03 136.52 32.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.449 ' ND2' ' HG2' ' A' ' 69' ' ' GLU . 11.2 p30 -71.17 173.2 7.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.015 0.436 . . . . 0.0 110.728 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.37 -41.21 94.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.009 -175.255 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.87 79.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.599 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.548 ' O ' HG13 ' A' ' 73' ' ' ILE . 58.7 mm-40 -59.6 -52.85 63.76 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.517 ' O ' HG13 ' A' ' 74' ' ' ILE . 32.2 m-70 -52.46 -41.7 63.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.604 178.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 54.3 mt-10 -66.38 -45.64 79.38 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.709 -177.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.0 m -59.13 -47.0 86.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.666 0.269 . . . . 0.0 110.565 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.3 mt -50.99 -62.32 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.75 -178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.7 mt -74.59 -24.69 18.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.21 -172.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.0 t -68.04 -29.75 68.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.92 -25.17 43.69 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.911 0.386 . . . . 0.0 110.257 176.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.504 HD13 HG12 ' A' ' 55' ' ' ILE . 37.8 tp -67.59 -37.84 83.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.941 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.59 -1.49 10.26 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.688 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -107.1 133.71 51.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.848 0.356 . . . . 0.0 110.93 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.554 ' OD1' ' HB3' ' A' ' 82' ' ' SER . 23.9 t-20 -66.19 117.46 43.3 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.462 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.78 -5.6 17.49 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.632 2.221 . . . . 0.0 112.913 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.554 ' HB3' ' OD1' ' A' ' 80' ' ' ASN . 42.1 t -80.31 -9.01 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 177.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -69.57 -21.67 63.6 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -112.67 108.62 17.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.288 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -83.12 -41.72 18.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.259 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -89.36 150.48 22.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.068 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -37.96 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.355 176.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.32 -52.0 60.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.575 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -61.23 -43.57 98.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.025 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 94' ' ' ILE . 94.6 mtt180 -64.3 -41.89 96.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.319 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -66.77 -45.71 87.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.137 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 -38.65 80.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.818 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -70.91 -39.18 72.89 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.921 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.4 mt -66.07 -32.5 58.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.228 0.537 . . . . 0.0 109.94 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 98' ' ' ILE . 4.0 mm? -73.86 -21.25 60.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.968 174.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -68.85 -33.05 73.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.717 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.435 HE21 HG13 ' A' ' 55' ' ' ILE . 2.6 mp0 -67.75 -36.35 80.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 109.988 175.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 95' ' ' LEU . 43.2 mt -67.61 -32.54 57.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.149 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.61 -42.96 97.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.614 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.4 -28.54 65.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.059 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -77.96 -3.06 39.99 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.263 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.93 -21.06 60.74 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.076 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.25 155.82 33.82 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.4 tp -79.71 -41.59 26.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.517 ' OE2' ' HA ' ' A' ' 108' ' ' HIS . 31.5 tt0 -68.49 121.05 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -68.21 98.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.184 0.516 . . . . 0.0 111.828 -174.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 39.4 49.71 1.92 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.224 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.517 ' HA ' ' OE2' ' A' ' 105' ' ' GLU . 34.5 m170 69.98 137.92 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.191 -0.913 . . . . 0.0 113.303 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -69.56 128.63 37.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -57.22 -41.76 80.09 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -168.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p80 . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.183 -0.913 . . . . 0.0 109.395 177.466 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.681 ' HG3' ' H ' ' A' ' 2' ' ' PHE . 45.2 tpp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.681 ' H ' ' HG3' ' A' ' 1' ' ' MET . 63.5 m-85 -100.04 148.6 24.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.545 0.212 . . . . 0.0 110.723 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.6 p -121.29 132.22 54.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.139 0.495 . . . . 0.0 110.943 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.6 128.87 55.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.356 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 6.0 ttpm? -114.13 121.63 44.36 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.626 0.25 . . . . 0.0 110.502 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.619 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 55.2 tp -62.84 124.95 22.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.99 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.0 pt -120.43 5.42 6.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.761 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -132.89 104.76 6.74 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.365 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.86 -121.27 5.64 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.59 ' HD2' ' HB2' ' A' ' 21' ' ' ALA . 41.9 tptt -169.38 -45.66 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 p -135.56 113.45 11.09 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.561 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -123.12 112.8 18.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.273 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.484 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 28.2 t-20 -92.63 107.79 19.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.941 0.401 . . . . 0.0 110.528 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.32 110.3 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.733 177.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 65.17 -80.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.808 0.693 . . . . 0.0 111.091 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -137.31 -1.93 2.43 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.237 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.425 ' N ' HD13 ' A' ' 17' ' ' ILE . 4.1 mp -104.64 115.98 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -178.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.3 m -89.38 106.25 18.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.927 0.394 . . . . 0.0 110.396 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -85.38 146.6 26.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.211 178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 75.7 mtt180 -121.25 132.46 54.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.193 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.619 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.51 112.93 1.96 Allowed 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.024 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.51 -12.03 25.76 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.058 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.7 t -116.63 119.55 62.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.649 0.261 . . . . 0.0 111.129 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 9.7 m -82.29 123.24 28.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -119.1 143.94 46.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.75 0.31 . . . . 0.0 110.642 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -70.74 131.24 43.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.421 -175.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.2 m -131.19 151.4 78.81 Favored Pre-proline 0 C--O 1.235 0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.537 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.512 ' HD2' HD13 ' A' ' 31' ' ' LEU . 16.9 Cg_exo -68.43 166.16 26.54 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.81 2.34 . . . . 0.0 111.671 175.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -62.14 -33.9 75.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.286 -175.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.96 -46.25 90.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.775 0.321 . . . . 0.0 110.63 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.512 HD13 ' HD2' ' A' ' 28' ' ' PRO . 65.3 mt -74.54 -23.22 58.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.697 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -62.63 -46.48 88.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 176.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 24.5 tp10 -76.22 -34.61 59.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.216 0.531 . . . . 0.0 110.198 177.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.425 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 49.5 t80 -58.55 -48.55 80.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.269 177.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.554 HD23 ' CE2' ' A' ' 41' ' ' PHE . 79.6 mt -79.55 -15.19 58.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.684 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.453 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 45.1 t30 -62.01 -40.56 96.1 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 173.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.5 5.32 31.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.915 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.456 ' HB2' ' HA ' ' A' ' 35' ' ' LEU . 32.0 m-80 -123.9 97.51 41.05 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.824 0.345 . . . . 0.0 110.427 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -70.77 63.93 2.39 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 123.4 2.733 . . . . 0.0 113.359 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.418 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 81.1 m-85 -120.43 -14.02 8.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.011 173.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.554 ' CE2' HD23 ' A' ' 35' ' ' LEU . 57.3 m-85 -129.21 151.42 49.9 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.211 -167.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.458 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.7 tt -97.24 118.45 43.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 166.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.6 mt -94.35 129.28 41.11 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.227 -175.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 m -142.62 147.17 35.37 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.69 105.03 12.57 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 172.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -106.72 111.37 23.87 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.338 -175.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.9 tp -98.35 147.14 24.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.644 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.27 89.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.258 0.552 . . . . 0.0 110.215 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -156.51 -41.1 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.689 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -92.4 8.18 39.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.885 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -144.25 134.74 24.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.759 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -127.86 172.63 10.69 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -123.36 80.2 53.33 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 110.157 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -96.04 57.25 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.633 2.889 . . . . 0.0 113.673 -171.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -174.94 35.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 122.293 1.044 . . . . 0.0 109.496 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -156.72 82.41 0.95 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.989 -172.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.414 ' N ' HD12 ' A' ' 98' ' ' ILE . 70.1 m-85 -142.37 150.06 40.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.687 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.91 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 14.0 m -60.82 138.75 58.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.562 0.22 . . . . 0.0 111.155 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.617 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.1 -37.43 77.13 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.171 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.493 ' H ' HG21 ' A' ' 58' ' ' THR . 18.6 m -70.01 -20.51 63.27 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.695 177.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.91 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 47.8 mm-40 -80.93 -45.62 16.42 Favored 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 120.227 -0.589 . . . . 0.0 109.713 173.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.46 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 87.4 mt -68.03 -18.58 64.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.842 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.617 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 1.6 mptm? -67.01 -33.46 75.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.943 0.402 . . . . 0.0 110.494 174.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.74 -22.01 27.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.049 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.441 ' HE1' ' HB3' ' A' ' 69' ' ' GLU . 96.9 mtp -73.32 136.69 44.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 110.423 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -70.65 167.36 18.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.261 -174.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 1.5 tmmt? -60.51 -41.24 93.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.9 68.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.862 176.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.441 ' HB3' ' HE1' ' A' ' 65' ' ' MET . 13.7 mm-40 -67.45 -50.01 61.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.204 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.479 ' HE1' HD11 ' A' ' 91' ' ' ILE . 85.2 m-70 -52.14 -44.5 64.59 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.698 175.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.547 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 86.4 mt-10 -60.42 -53.78 53.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.679 176.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.5 m -51.96 -44.39 63.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.972 0.415 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.1 mt -59.72 -62.52 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.711 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.463 HD12 ' HB3' ' A' ' 81' ' ' PRO . 4.4 mt -78.13 -10.4 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.627 -170.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m -80.82 -33.22 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.129 -0.357 . . . . 0.0 110.052 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -70.35 -27.11 64.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.108 0.48 . . . . 0.0 109.794 174.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.3 -23.35 65.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.968 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.41 18.61 52.22 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.579 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -40.08 6.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.659 0.229 . . . . 0.0 110.655 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 67.91 105.64 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.786 0.679 . . . . 0.0 110.832 -176.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.547 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 90.2 Cg_endo -84.2 34.17 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.805 2.337 . . . . 0.0 112.864 -177.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 p -76.41 -26.37 55.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.483 177.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.28 -31.99 62.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.435 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -82.56 108.86 16.27 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.57 -31.79 28.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.273 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.858 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 86.1 m-20 -92.27 141.69 28.29 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.276 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -60.4 -37.76 81.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.468 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.858 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 31.2 mm-40 -65.81 -35.05 79.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.465 0.65 . . . . 0.0 109.62 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -70.53 -35.4 73.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 176.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 87' ' ' ALA . 37.5 mm -61.93 -54.07 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -58.31 -40.27 81.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.869 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -67.7 -46.15 73.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.525 0.202 . . . . 0.0 111.067 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.76 -41.49 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.14 0.495 . . . . 0.0 109.885 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.475 HD12 HD11 ' A' ' 98' ' ' ILE . 4.2 mm? -67.99 -29.65 68.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.111 178.179 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.453 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 38.5 tptt -72.52 -18.43 61.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.058 0.456 . . . . 0.0 110.778 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.468 ' O ' ' HG3' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -83.15 -30.28 27.97 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.475 HD11 HD12 ' A' ' 95' ' ' LEU . 39.4 mt -71.19 -35.61 58.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -63.61 -25.11 68.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.532 176.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -84.99 -17.31 37.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.246 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 97' ' ' GLN . 67.7 mttm -94.83 97.52 10.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.293 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 146.93 42.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.217 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 68.49 1.31 2.9 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 173.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.7 mp 50.82 57.69 6.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.06 160.14 32.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.304 -173.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -161.95 80.93 0.56 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.481 176.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -89.47 142.27 27.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.274 -173.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -149.09 116.96 6.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.286 177.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -79.11 166.5 22.2 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 176.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -74.98 71.98 2.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.151 0.501 . . . . 0.0 109.826 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 C--O 1.244 0.785 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.116 -178.42 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -92.33 113.11 25.3 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.8 p -114.9 148.36 38.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.966 0.412 . . . . 0.0 110.618 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.95 134.54 46.83 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.133 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.783 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 1.6 ttmp? -120.16 118.75 31.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.135 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.668 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 40.0 tp -71.3 128.2 35.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.813 HG13 ' HG3' ' A' ' 8' ' ' LYS . 41.5 pt -113.74 -17.16 8.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.866 0.365 . . . . 0.0 110.986 -177.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.813 ' HG3' HG13 ' A' ' 7' ' ' ILE . 96.5 mttt -133.1 138.69 46.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -177.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.66 -13.93 24.87 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.854 178.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.6 tttm 73.92 -52.89 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.532 0.733 . . . . 0.0 110.924 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.5 m -151.94 119.33 5.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.93 177.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.452 ' CE2' HG21 ' A' ' 14' ' ' VAL . 30.2 t80 -141.19 126.33 18.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.731 -178.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -92.14 125.49 36.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.912 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 ' CE2' ' A' ' 12' ' ' TYR . 47.9 t -104.81 104.94 17.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 175.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.5 mtt 65.41 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.112 -175.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.83 0.04 2.07 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.517 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.458 HD11 ' N ' ' A' ' 17' ' ' ILE . 3.7 mp -101.3 123.48 54.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 m -83.31 116.61 22.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.943 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.44 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 96.9 m-85 -106.23 140.61 38.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.745 0.307 . . . . 0.0 110.189 175.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -127.66 148.28 50.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.668 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.21 112.29 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.624 0.249 . . . . 0.0 111.167 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.08 5.28 57.36 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.387 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.6 112.37 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.997 0.427 . . . . 0.0 110.15 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.783 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 16.0 m -92.45 123.98 36.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.63 150.41 51.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.819 0.343 . . . . 0.0 111.001 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 m -79.78 138.81 37.36 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.127 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.497 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 34.7 m -134.93 158.23 75.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.723 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.465 ' HD2' HD11 ' A' ' 31' ' ' LEU . 16.6 Cg_exo -68.95 171.32 13.76 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.769 2.313 . . . . 0.0 111.577 173.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 11.4 tmtt? -66.19 -31.13 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -177.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.84 -53.81 52.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.451 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.497 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 65.3 mt -70.23 -34.69 73.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.214 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -56.18 -46.77 79.26 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -71.53 -43.15 66.98 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.895 0.379 . . . . 0.0 110.574 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -58.0 -38.52 76.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.662 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.52 HD22 ' CE1' ' A' ' 41' ' ' PHE . 78.6 mt -88.75 -9.01 53.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.047 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -76.44 -23.94 53.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 172.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -84.41 -12.95 53.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.526 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -112.41 103.27 55.34 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.659 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.55 11.44 0.48 Allowed 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.411 2.74 . . . . 0.0 114.195 -173.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -85.1 -3.72 58.9 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.575 ' CZ ' HD11 ' A' ' 6' ' ' LEU . 79.1 m-85 -118.82 131.47 56.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.11 -176.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.527 HG13 HD13 ' A' ' 7' ' ' ILE . 27.9 mt -97.45 104.12 15.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 166.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.7 mp -88.74 162.44 16.24 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.357 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m -149.91 154.31 38.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.001 -177.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -129.35 108.93 10.68 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -101.32 126.77 48.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.82 106.24 0.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.725 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -139.3 137.58 35.97 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 175.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.22 146.87 53.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.328 0.585 . . . . 0.0 111.679 -173.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -77.81 -174.93 3.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.792 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.415 ' HE3' ' HB2' ' A' ' 51' ' ' LYS . 25.8 ttmt -74.29 157.47 35.73 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -75.47 -173.19 2.04 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -55.43 126.45 62.78 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.342 -171.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.574 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 71.8 Cg_endo -77.71 46.94 2.17 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 123.269 2.646 . . . . 0.0 112.465 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.647 HG12 HD12 ' A' ' 77' ' ' LEU . 9.6 tp -170.7 22.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.454 1.121 . . . . 0.0 109.042 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.694 HD21 HG12 ' A' ' 98' ' ' ILE . 2.6 t-20 -159.11 98.86 1.47 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.679 -173.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.574 ' OH ' ' HA ' ' A' ' 54' ' ' PRO . 95.9 m-85 -140.11 -174.66 3.99 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.51 -176.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.707 ' HB ' ' HB3' ' A' ' 61' ' ' GLU . 3.0 m -79.59 129.47 34.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.49 ' HB3' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -63.29 -39.65 95.17 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.822 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.48 ' HA ' ' HE3' ' A' ' 63' ' ' LYS . 50.2 m -64.95 -29.3 70.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.978 0.418 . . . . 0.0 109.971 174.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.707 ' HB3' ' HB ' ' A' ' 58' ' ' THR . 39.7 tt0 -76.23 -38.75 55.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.96 -27.52 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.245 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 60' ' ' SER . 48.3 mtmt -76.42 -1.24 26.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.26 26.46 8.2 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 172.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.485 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 24.1 mmt -119.33 161.71 20.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.554 -0.323 . . . . 0.0 110.444 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.481 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 16.2 m-80 -91.62 -167.81 1.88 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.472 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -79.46 -35.22 40.69 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.229 -177.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.12 77.23 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.409 0.443 . . . . 0.0 112.017 -171.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' HG3' ' HB3' ' A' ' 65' ' ' MET . 2.6 pm0 -63.03 -47.0 84.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.775 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.499 ' HE1' HG12 ' A' ' 91' ' ' ILE . 19.7 m-70 -55.31 -41.37 72.28 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.565 0.222 . . . . 0.0 111.079 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.463 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.6 mt-10 -65.73 -50.15 65.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.986 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 m -58.59 -38.11 77.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 69' ' ' GLU . 69.1 mt -54.61 -61.97 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.407 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.492 HD11 ' HB3' ' A' ' 81' ' ' PRO . 2.0 mt -79.3 -21.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.983 -170.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.5 p -71.19 -25.5 62.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.541 -0.464 . . . . 0.0 109.779 175.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -76.25 -33.35 59.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.107 172.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.647 HD12 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -62.47 -38.89 91.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.117 0.484 . . . . 0.0 110.708 174.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.32 -46.99 1.04 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.233 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.511 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 48.8 ttt85 -77.37 111.7 13.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.134 0.492 . . . . 0.0 109.768 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -62.32 130.66 93.33 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.085 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.492 ' HB3' HD11 ' A' ' 74' ' ' ILE . 91.9 Cg_endo -86.53 24.92 0.71 Allowed 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 123.254 2.636 . . . . 0.0 112.718 -177.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.2 m -73.65 -36.81 65.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.921 0.391 . . . . 0.0 110.344 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -73.59 -27.42 61.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.535 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -82.52 108.88 16.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.293 177.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -99.37 -54.61 2.91 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.05 -171.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -83.15 158.47 22.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.903 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.11 73.23 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.173 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -50.44 -49.23 55.57 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.637 0.586 . . . . 0.0 110.882 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.18 -49.39 74.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.981 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.7 mtt180 -64.2 -43.52 94.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.085 -176.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.499 HG12 ' HE1' ' A' ' 70' ' ' HIS . 91.1 mt -71.3 -43.88 73.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.178 -176.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.485 ' HA ' HD11 ' A' ' 95' ' ' LEU . . . -58.81 -40.21 83.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 111.174 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.511 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 41.9 t80 -68.1 -42.57 80.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.47 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.498 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.9 mt -60.92 -39.71 82.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.524 ' HA ' HD13 ' A' ' 98' ' ' ILE . 38.3 mt -55.55 -40.73 72.26 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.025 177.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 92' ' ' ALA . 66.0 mttm -60.33 -34.27 73.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.391 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -83.55 -18.99 36.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.014 0.435 . . . . 0.0 110.621 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.694 HG12 HD21 ' A' ' 56' ' ' ASN . 78.1 mt -70.07 -41.79 79.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.912 176.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -75.84 -48.22 22.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.559 176.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -120.22 88.4 2.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.125 0.488 . . . . 0.0 111.117 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -90.6 -44.15 9.72 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 78.06 -61.2 3.8 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.505 -0.77 . . . . 0.0 113.89 172.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.768 ' HG2' ' H ' ' A' ' 104' ' ' LEU . 21.3 tt0 66.68 -156.85 0.24 Allowed 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -172.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.768 ' H ' ' HG2' ' A' ' 103' ' ' GLU . 8.2 mp 56.75 62.74 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.263 0.554 . . . . 0.0 109.545 -175.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.34 -47.07 74.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.119 -173.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -162.29 118.36 1.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.111 0.481 . . . . 0.0 111.011 -176.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.522 ' O ' ' HB3' ' A' ' 108' ' ' HIS . 76.1 t60 -161.6 143.61 11.66 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.527 -0.761 . . . . 0.0 108.976 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.522 ' HB3' ' O ' ' A' ' 107' ' ' HIS . 36.9 t60 78.84 -37.92 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.602 0.564 . . . . 0.0 110.418 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -68.85 120.19 14.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 172.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 30.0 p80 -134.57 177.12 8.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.427 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.337 -0.839 . . . . 0.0 109.215 173.438 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -124.08 161.45 25.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.299 . . . . 0.0 110.571 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 p -127.42 139.55 52.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.431 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.17 128.2 54.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -111.32 105.5 14.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.018 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 50.6 tp -65.72 116.89 7.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.528 HD11 HG13 ' A' ' 42' ' ' ILE . 42.5 pt -107.1 -29.87 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.811 0.339 . . . . 0.0 111.58 -175.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 50.4 mttm -106.5 128.91 54.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.322 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.24 -128.51 8.57 Favored Glycine 0 N--CA 1.441 -0.981 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.126 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -170.12 -46.94 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -175.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.26 113.49 6.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.685 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -123.1 104.21 9.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.338 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.515 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 23.8 t-20 -90.23 122.2 32.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.848 0.356 . . . . 0.0 111.034 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.8 t -119.99 111.78 34.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.763 174.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.1 mtt 64.52 -95.29 0.04 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.884 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.94 17.42 6.33 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.056 -0.593 . . . . 0.0 111.712 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.449 HD12 HD13 ' A' ' 31' ' ' LEU . 4.6 mp -123.42 110.87 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 30.5 m -90.53 107.34 19.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.631 177.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.428 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 91.9 m-85 -84.91 151.02 24.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 179.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 46.6 mtm180 -133.83 145.68 49.93 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.562 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -54.61 114.82 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.993 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.84 -7.16 67.54 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.626 177.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.6 t -100.82 125.43 54.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.873 0.368 . . . . 0.0 111.275 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 m -94.59 121.73 36.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.122 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -124.57 146.06 49.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.601 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.8 m -75.13 126.71 31.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.6 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.9 m -122.75 154.33 63.65 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-O 120.678 0.275 . . . . 0.0 111.45 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.517 ' HD2' HD12 ' A' ' 31' ' ' LEU . 21.2 Cg_exo -66.86 164.23 30.4 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.8 2.334 . . . . 0.0 111.015 172.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -64.19 -32.58 74.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.001 -175.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -54.57 -52.02 63.44 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.995 0.426 . . . . 0.0 110.489 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.517 HD12 ' HD2' ' A' ' 28' ' ' PRO . 49.3 mt -67.92 -33.63 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.472 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.561 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 87.4 t80 -59.13 -44.13 92.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.879 0.371 . . . . 0.0 110.305 178.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -77.7 -40.17 42.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -59.76 -40.43 88.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.329 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -87.67 -13.48 42.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 8.1 t30 -63.83 -36.9 85.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.16 8.18 16.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.468 176.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 31.5 m-80 -127.99 91.93 43.46 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.118 0.485 . . . . 0.0 110.157 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -75.14 57.0 4.51 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.745 2.963 . . . . 0.0 114.643 -169.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 3.3 p90 -133.58 22.36 3.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.649 0.738 . . . . 0.0 110.121 170.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.427 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.79 148.93 50.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.766 175.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 7' ' ' ILE . 50.3 mt -97.03 110.09 24.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 163.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.561 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 68.6 mt -91.84 133.1 35.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.367 -175.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.29 168.94 18.68 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.419 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -136.5 104.86 5.71 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 167.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -104.57 167.62 9.62 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.048 -171.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -92.95 166.74 12.24 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.847 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -130.9 -53.99 1.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.468 178.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -73.09 106.91 5.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.795 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -126.98 -5.22 6.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.327 0.584 . . . . 0.0 109.907 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.474 ' C ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -96.48 16.59 18.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.756 -174.924 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -76.44 176.63 8.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.746 0.308 . . . . 0.0 110.754 -175.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.35 151.16 41.21 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.815 -177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.425 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 11.9 Cg_exo -71.0 94.46 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.938 2.426 . . . . 0.0 113.033 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.814 HG12 HD11 ' A' ' 77' ' ' LEU . 9.5 tp -179.47 26.67 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 122.047 0.927 . . . . 0.0 109.716 175.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.519 ' HB3' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -163.78 98.09 0.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.654 -174.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -142.3 160.13 40.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.502 -177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 1.7 m -57.16 137.3 56.04 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.467 0.479 . . . . 0.0 110.175 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.431 ' HB3' HD12 ' A' ' 95' ' ' LEU . 0.6 OUTLIER -62.81 -31.17 72.11 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.369 -0.532 . . . . 0.0 109.865 176.8 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.2 t -64.87 -41.38 95.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.599 172.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -68.35 -42.17 79.65 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.35 179.525 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.454 HD21 ' SD ' ' A' ' 65' ' ' MET . 99.9 mt -66.39 -32.62 74.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.41 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HG3' HD13 ' A' ' 91' ' ' ILE . 43.1 mtmt -76.71 -16.96 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.055 0.455 . . . . 0.0 110.538 175.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.05 23.27 36.63 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.631 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.1 mtt -117.67 160.71 20.85 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.271 0.558 . . . . 0.0 111.042 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.547 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 38.6 t30 -74.02 152.54 39.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.055 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 49.4 mtmt -52.45 -47.07 66.64 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.337 177.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.3 64.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.776 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.547 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 26.8 mm-40 -66.21 -44.45 83.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.575 ' O ' HG13 ' A' ' 74' ' ' ILE . 76.3 m-70 -57.64 -42.84 84.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.09 0.472 . . . . 0.0 110.247 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.5 -46.25 86.96 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.65 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.8 p -72.57 -36.18 68.14 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.643 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 69' ' ' GLU . 81.7 mt -56.6 -55.86 17.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.18 0.514 . . . . 0.0 110.716 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.4 mt -77.14 -18.58 14.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.019 0.438 . . . . 0.0 110.537 -175.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.1 t -64.65 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.11 -34.97 79.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.297 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.814 HD11 HG12 ' A' ' 55' ' ' ILE . 58.2 tp -59.06 -34.89 72.48 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.183 0.515 . . . . 0.0 110.545 174.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.22 14.73 11.4 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.036 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.417 ' HD3' ' OH ' ' A' ' 93' ' ' TYR . 48.9 ttt180 -145.78 92.76 2.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.147 0.498 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.573 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 51.0 t30 -58.67 132.48 85.99 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.676 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.573 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 85.2 Cg_exo -44.95 84.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.987 3.125 . . . . 0.0 113.575 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.3 t -78.83 108.63 12.41 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.925 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.5 t70 51.68 62.05 2.9 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.978 0.799 . . . . 0.0 111.731 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -116.97 108.09 15.36 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 171.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -99.6 -32.4 11.11 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.065 0.46 . . . . 0.0 110.246 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -72.1 124.33 24.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.98 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.43 88.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.888 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.56 -25.87 67.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.288 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -67.38 -42.68 82.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.685 0.279 . . . . 0.0 110.551 -177.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 mtt-85 -62.07 -43.59 98.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.372 0.606 . . . . 0.0 109.779 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.411 HD13 ' HG3' ' A' ' 63' ' ' LYS . 45.1 mt -67.63 -42.51 86.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.229 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.35 78.17 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.271 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.417 ' OH ' ' HD3' ' A' ' 79' ' ' ARG . 30.1 t80 -68.91 -38.84 79.83 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.206 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.438 ' O ' HG13 ' A' ' 98' ' ' ILE . 73.6 mt -65.82 -47.16 86.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.02 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 59' ' ' GLU . 95.1 mt -62.09 -38.36 88.58 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.082 0.468 . . . . 0.0 111.013 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -61.85 -36.5 81.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.426 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -72.91 -22.51 60.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.836 -179.383 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.519 HG12 ' HB3' ' A' ' 56' ' ' ASN . 53.6 mt -73.57 -40.31 54.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 109.686 175.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.64 -28.49 62.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.156 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.407 ' N ' HD21 ' A' ' 100' ' ' ASN . 0.9 OUTLIER -95.44 13.01 27.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.807 177.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 97' ' ' GLN . 83.5 tttt -96.08 112.13 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.923 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 132.17 83.18 0.24 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -175.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -64.73 106.66 1.24 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.829 0.347 . . . . 0.0 111.279 -175.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.4 tt -82.33 74.99 9.27 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -106.13 157.64 17.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.021 -177.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -67.24 154.61 40.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.701 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -57.29 128.06 35.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.51 72.65 5.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.212 0.53 . . . . 0.0 111.728 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -90.07 10.65 23.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.572 175.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -83.46 13.41 4.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.755 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.486 -0.768 . . . . 0.0 109.742 176.2 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 121.047 0.451 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.415 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 61.3 m-85 -124.29 121.44 35.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.484 176.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.4 t -126.37 147.39 49.77 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.63 135.23 54.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.933 0.397 . . . . 0.0 110.918 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.482 ' HB2' ' HG ' ' A' ' 24' ' ' SER . 86.1 tttt -119.4 118.35 30.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.462 -179.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.766 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.66 130.42 43.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.52 HD11 HG13 ' A' ' 42' ' ' ILE . 40.4 pt -120.14 -0.52 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.835 0.35 . . . . 0.0 111.408 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -135.71 121.54 19.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.79 -174.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 100.43 -125.05 8.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.45 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.489 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 38.6 ttmt -155.37 -52.08 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.5 m -144.29 126.48 15.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.907 0.384 . . . . 0.0 111.168 -178.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -142.5 131.04 22.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.033 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 65.1 t30 -93.92 120.54 34.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.113 0.482 . . . . 0.0 111.166 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 90.7 t -99.89 95.17 3.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.914 176.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.3 mtt 62.8 -81.02 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.826 -176.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.17 -2.13 5.59 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.96 177.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -103.57 105.62 18.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -178.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 4.1 m -86.2 117.69 25.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.878 0.371 . . . . 0.0 110.545 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CE1' ' HB2' ' A' ' 25' ' ' GLN . 96.1 m-85 -103.88 152.95 21.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 36.5 mtm180 -124.09 139.77 53.61 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.821 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.766 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -51.13 118.63 3.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.108 0.48 . . . . 0.0 111.24 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.89 -22.46 35.23 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.3 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -93.16 122.4 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 110.698 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.482 ' HG ' ' HB2' ' A' ' 5' ' ' LYS . 15.9 m -95.19 125.55 39.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.746 175.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HB2' ' CE1' ' A' ' 19' ' ' PHE . 25.9 mt-30 -130.87 140.72 50.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.061 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.0 p -67.7 133.25 48.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.741 -175.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -121.96 149.63 54.29 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.327 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.515 ' HD2' HD12 ' A' ' 31' ' ' LEU . 22.5 Cg_exo -65.74 163.12 31.72 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.766 2.311 . . . . 0.0 110.774 171.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -63.27 -29.04 70.44 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.433 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.75 -53.69 50.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.437 175.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.515 HD12 ' HD2' ' A' ' 28' ' ' PRO . 67.2 mt -67.98 -25.55 65.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.038 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.415 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 81.2 t80 -59.68 -47.26 86.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 176.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -73.21 -38.75 65.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.807 0.337 . . . . 0.0 110.628 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -58.29 -47.64 83.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.914 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.527 ' HB2' HD22 ' A' ' 43' ' ' LEU . 89.2 mt -80.63 -22.21 40.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.035 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.29 -28.79 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.512 0.673 . . . . 0.0 109.729 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -81.39 0.05 39.19 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.59 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -121.76 116.61 30.28 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.205 0.526 . . . . 0.0 111.258 -176.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.59 10.37 2.25 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 123.169 2.579 . . . . 0.0 114.605 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -107.02 12.09 29.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.438 0.637 . . . . 0.0 110.482 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -127.35 127.58 44.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.325 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.52 HG13 HD11 ' A' ' 7' ' ' ILE . 50.4 mt -97.52 109.96 24.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.527 HD22 ' HB2' ' A' ' 35' ' ' LEU . 5.2 mp -94.83 149.78 20.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.822 -178.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.7 m -128.79 117.3 20.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -101.39 122.97 44.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.484 172.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -102.44 108.31 19.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.9 mp -86.5 96.22 9.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.577 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -120.33 23.78 10.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.068 177.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -85.39 -50.41 7.33 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.92 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -139.85 82.19 1.86 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 174.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -97.13 -12.58 22.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.21 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 11.2 m-20 -96.89 176.38 5.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.458 178.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -90.77 113.12 56.81 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.816 -171.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 52' ' ' ASP . 86.6 Cg_endo -100.46 -175.55 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 123.485 2.79 . . . . 0.0 111.967 172.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.67 HG12 HD23 ' A' ' 77' ' ' LEU . 10.7 tp 38.78 61.2 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.863 0.865 . . . . 0.0 112.951 173.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -174.43 87.52 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.586 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -142.86 161.94 36.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.736 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.644 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 2.0 m -74.19 143.74 45.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.627 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -34.69 78.77 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.357 0.599 . . . . 0.0 109.959 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.6 m -75.83 -25.95 56.74 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.582 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.711 ' HG2' ' HE3' ' A' ' 65' ' ' MET . 56.2 tt0 -77.19 -44.81 28.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.405 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.685 ' HB3' ' HE1' ' A' ' 70' ' ' HIS . 89.9 mt -65.2 -33.6 76.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.585 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -72.45 -12.75 61.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.843 176.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.56 28.48 13.26 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 176.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.711 ' HE3' ' HG2' ' A' ' 61' ' ' GLU . 58.2 mtt -119.67 -171.24 2.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 111.078 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.485 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 4.9 t30 -114.7 162.92 16.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.668 176.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 18.9 ptmt -56.05 -40.24 73.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.476 ' H ' ' ND2' ' A' ' 66' ' ' ASN . . . -56.72 -49.68 74.44 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -170.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.539 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 pm0 -59.39 -46.88 87.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.077 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.685 ' HE1' ' HB3' ' A' ' 62' ' ' LEU . 89.0 m-70 -50.38 -50.7 50.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.972 0.415 . . . . 0.0 110.922 177.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.538 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 4.0 mm-40 -61.88 -43.66 98.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.704 -176.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -63.03 -44.4 96.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.742 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.8 mt -52.63 -58.33 2.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.919 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.473 HD11 ' HB3' ' A' ' 81' ' ' PRO . 0.8 OUTLIER -75.48 -21.88 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.043 -172.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.9 m -70.63 -23.95 62.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.848 0.356 . . . . 0.0 110.699 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.96 -30.11 28.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.101 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.67 HD23 HG12 ' A' ' 55' ' ' ILE . 51.2 tp -67.75 -37.97 82.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.848 174.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 133.94 -60.82 0.65 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.016 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.4 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 62.1 ttt180 -65.92 108.1 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.412 HD21 ' HA ' ' A' ' 80' ' ' ASN . 11.2 m120 -63.74 142.36 98.04 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.649 -175.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.538 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 55.2 Cg_endo -67.13 -7.6 19.31 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 123.569 2.846 . . . . 0.0 112.51 -176.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.7 m -64.25 -17.58 63.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.77 179.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -76.2 -20.34 57.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.257 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -111.11 112.72 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.016 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.75 -36.04 32.51 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -173.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.405 ' HB3' ' OD1' ' A' ' 88' ' ' ASP . 66.8 t30 -107.01 164.22 12.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.74 0.305 . . . . 0.0 110.642 -176.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 90' ' ' ARG . . . -64.89 -34.12 77.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.847 -177.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 86' ' ' ASN . 22.8 p-10 -64.24 -47.4 79.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.207 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -60.25 -38.25 82.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.911 0.386 . . . . 0.0 110.843 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.3 mtt85 -58.78 -52.22 66.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.431 175.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.77 -44.54 96.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.258 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.24 -41.32 75.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.432 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.4 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 27.2 t80 -72.58 -34.86 67.74 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.998 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.8 mt -67.77 -41.87 85.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.458 HD11 HD12 ' A' ' 98' ' ' ILE . 4.4 mm? -65.71 -38.53 89.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.766 176.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -57.33 -37.71 72.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.929 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -7.77 59.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.948 -175.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.458 HD12 HD11 ' A' ' 95' ' ' LEU . 27.9 mt -72.91 -44.82 57.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 173.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -78.94 -13.54 59.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.571 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -61.39 -25.26 67.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.708 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.94 120.93 12.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.497 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -122.98 -32.89 0.88 Allowed Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.006 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -111.08 85.2 2.07 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.054 0.454 . . . . 0.0 110.11 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 67.9 tp -103.27 -47.32 4.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.13 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -100.98 -160.75 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.618 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 10.6 p80 -122.73 87.85 2.82 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.395 0.617 . . . . 0.0 111.585 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -136.54 8.84 3.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.798 0.809 . . . . 0.0 108.868 170.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 66.6 t60 -103.66 21.22 16.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.289 -178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -91.38 -20.49 21.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.766 -174.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -109.8 119.53 39.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.797 0.332 . . . . 0.0 111.753 -172.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.62 -0.705 . . . . 0.0 109.538 174.734 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' HG3' ' OD1' ' A' ' 48' ' ' ASN . 64.6 mtm . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -114.1 131.34 56.44 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.9 p -122.9 136.35 54.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.771 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.4 117.72 29.25 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.657 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.453 ' HB2' ' HA ' ' A' ' 24' ' ' SER . 34.9 ttpt -106.63 121.22 43.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.062 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.812 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 26.0 tp -66.42 116.08 7.04 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.549 HG13 ' HG3' ' A' ' 8' ' ' LYS . 31.9 pt -106.15 -13.08 9.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 120.96 0.41 . . . . 0.0 111.586 -174.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HG3' HG13 ' A' ' 7' ' ' ILE . 95.2 mttt -130.36 109.88 11.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.183 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.6 -120.49 2.56 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.229 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -171.72 -66.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 m -135.05 113.05 11.06 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.438 ' CE2' HG21 ' A' ' 14' ' ' VAL . 26.1 t80 -133.08 130.55 39.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.95 0.405 . . . . 0.0 111.056 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -97.65 125.53 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.831 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.482 HG11 HD22 ' A' ' 35' ' ' LEU . 44.4 t -112.58 115.89 51.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.415 ' SD ' HD21 ' A' ' 31' ' ' LEU . 61.4 mtt 67.88 -73.85 0.08 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.478 0.711 . . . . 0.0 111.076 -177.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 19.75 0.28 Allowed Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.475 HD11 HD12 ' A' ' 31' ' ' LEU . 3.9 mp -118.15 137.34 52.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.0 m -95.08 118.0 31.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 111.548 -176.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -106.16 140.11 39.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.028 177.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -122.82 142.46 50.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.096 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.812 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -65.54 106.13 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.003 0.43 . . . . 0.0 110.725 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 109.6 -5.38 31.19 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.204 -178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.0 t -113.61 122.11 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.838 0.351 . . . . 0.0 110.705 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 12.4 m -82.13 100.59 9.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.216 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -86.72 142.26 28.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.624 -176.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.5 m -81.1 125.43 30.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.65 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 33.0 m -130.49 155.82 80.53 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.253 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -74.27 162.22 38.96 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.53 2.153 . . . . 0.0 110.539 170.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 83.1 tttt -60.55 -23.81 64.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.61 0.243 . . . . 0.0 110.824 -178.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -56.6 -52.08 66.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.083 0.468 . . . . 0.0 109.893 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 59.2 mt -75.78 -29.06 58.63 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.768 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 89.8 t80 -57.47 -43.26 83.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.006 0.432 . . . . 0.0 110.513 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -80.09 -40.01 28.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.27 0.557 . . . . 0.0 110.305 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.19 -35.1 76.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.958 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.482 HD22 HG11 ' A' ' 14' ' ' VAL . 90.3 mt -92.68 -15.72 26.39 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.259 -0.276 . . . . 0.0 110.901 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.43 -37.38 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.0 109.817 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.73 6.61 10.38 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.67 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -116.15 113.78 41.34 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.046 0.451 . . . . 0.0 110.424 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.92 23.74 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 123.206 2.604 . . . . 0.0 114.517 -171.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 6.8 p90 -122.25 16.69 10.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.498 0.666 . . . . 0.0 110.392 175.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.505 ' CZ ' HD11 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.49 135.5 49.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.779 173.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.441 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.7 tt -98.81 128.37 50.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.97 118.17 32.67 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.166 -0.613 . . . . 0.0 111.371 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -112.34 142.27 45.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.967 -176.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -100.51 105.68 17.14 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.94 23.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.376 0.608 . . . . 0.0 111.749 -173.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.9 mp -83.4 122.78 28.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.778 -177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.513 ' OD1' ' HG3' ' A' ' 1' ' ' MET . 12.0 m120 -97.05 172.39 7.88 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.483 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -90.01 143.94 26.35 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -57.78 137.88 56.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.201 0.524 . . . . 0.0 110.794 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -87.08 -21.43 26.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.051 -171.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -117.09 114.91 24.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.152 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -129.63 114.74 18.06 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -179.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.488 ' O ' HG21 ' A' ' 55' ' ' ILE . 17.2 Cg_endo -57.18 142.43 94.48 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 123.188 2.592 . . . . 0.0 113.436 -173.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.488 HG21 ' O ' ' A' ' 54' ' ' PRO . 7.6 tp 52.29 26.84 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.389 1.075 . . . . 0.0 111.951 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.417 ' HB2' ' HE3' ' A' ' 101' ' ' LYS . 6.2 t30 -147.62 80.75 1.5 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.448 0.642 . . . . 0.0 109.68 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -138.23 159.36 42.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.712 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.59 148.38 35.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.631 174.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 35.5 tt0 -57.43 -42.76 83.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 176.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m -59.85 -32.67 70.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.189 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.66 -37.27 59.75 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.102 0.477 . . . . 0.0 110.393 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.462 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 85.8 mt -81.25 -18.99 44.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.957 -177.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 31.2 mmtp -65.15 -29.81 70.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.973 0.416 . . . . 0.0 110.996 177.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.09 2.52 79.27 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.358 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.423 ' SD ' HD22 ' A' ' 62' ' ' LEU . 65.8 mtt -103.19 137.78 40.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.778 0.323 . . . . 0.0 110.222 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.462 ' O ' ' HD2' ' A' ' 70' ' ' HIS . 39.0 m-80 -74.78 171.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.776 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -58.2 -36.97 73.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.073 -178.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.88 91.33 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.541 0.526 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.524 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 mp0 -57.41 -47.13 82.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.901 0.382 . . . . 0.0 110.382 177.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.585 ' O ' HG13 ' A' ' 74' ' ' ILE . 36.1 m-70 -58.22 -41.63 84.52 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 177.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.568 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 43.4 mt-10 -59.57 -49.75 76.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.239 -178.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 p -63.99 -34.29 77.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.664 0.269 . . . . 0.0 111.259 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.7 mt -61.39 -54.88 29.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.16 0.505 . . . . 0.0 111.006 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.7 mt -75.34 -21.53 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.799 -174.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 73.9 m -64.57 -37.3 87.07 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.23 -34.26 75.91 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.179 175.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.454 HD12 HG22 ' A' ' 55' ' ' ILE . 42.8 tp -64.81 -37.63 88.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.775 175.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.36 23.16 5.84 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.728 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.495 ' HB3' HG23 ' A' ' 74' ' ' ILE . 3.9 tpt180 -125.31 131.65 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -66.02 116.12 29.74 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 121.513 0.673 . . . . 0.0 110.331 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -83.38 -5.33 11.01 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.827 2.352 . . . . 0.0 113.167 -175.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.5 t -77.57 -0.13 25.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.404 178.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -77.81 -15.89 58.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.413 0.625 . . . . 0.0 109.713 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -102.52 128.04 49.32 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.002 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -84.83 -26.02 27.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.905 0.383 . . . . 0.0 111.09 -173.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.512 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 30.4 p30 -126.01 169.75 12.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.332 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.29 -18.24 59.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.589 0.233 . . . . 0.0 111.271 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.09 -49.27 68.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.894 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -62.94 -32.62 73.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.823 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 46.4 mtt-85 -65.35 -40.02 93.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.987 178.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.0 mt -62.83 -47.44 92.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.199 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.92 -39.72 78.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.621 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.98 -45.39 77.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.791 0.329 . . . . 0.0 110.39 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.9 mt -66.21 -39.13 83.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.505 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.77 -30.05 70.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.833 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -80.56 -34.73 35.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.257 0.551 . . . . 0.0 110.32 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.66 -30.57 56.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.408 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.422 ' HA ' ' HD2' ' A' ' 101' ' ' LYS . 10.5 tt -69.44 -23.98 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 121.173 0.511 . . . . 0.0 109.794 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -72.22 -42.17 66.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.288 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -91.65 64.1 4.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.746 -178.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.437 ' HB3' ' HZ3' ' A' ' 101' ' ' LYS . 8.9 mtpm? -129.27 80.36 1.96 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.727 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -171.38 81.99 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.353 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -88.16 14.39 9.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.976 0.417 . . . . 0.0 111.157 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.55 102.66 14.8 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -92.84 149.81 21.02 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.534 -171.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -146.82 106.54 3.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.462 173.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -106.74 150.64 26.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.303 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -67.67 114.41 6.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.479 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -74.21 134.72 42.73 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -59.98 -61.39 2.64 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.591 0.234 . . . . 0.0 110.945 -173.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.285 -0.864 . . . . 0.0 109.718 175.604 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.457 ' SD ' HG21 ' A' ' 26' ' ' THR . 13.3 tmm? . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -114.65 142.57 46.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.582 0.23 . . . . 0.0 111.018 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.478 ' HB ' ' HB2' ' A' ' 24' ' ' SER . 26.0 p -129.6 142.78 50.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.842 0.353 . . . . 0.0 111.288 177.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 24' ' ' SER . . . -118.52 140.93 49.11 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 36.3 ttpt -122.07 123.29 41.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.146 0.498 . . . . 0.0 111.412 -175.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 3.4 tm? -73.86 125.28 27.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.182 176.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.516 HD13 HG13 ' A' ' 42' ' ' ILE . 43.4 pt -112.12 -15.06 10.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.601 -178.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.438 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 83.2 tttt -140.99 113.66 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.632 0.253 . . . . 0.0 110.811 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.68 -5.69 5.5 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.232 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.565 ' HZ1' ' HB2' ' A' ' 10' ' ' LYS . 4.7 ttmp? 73.6 -53.75 0.69 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.086 0.554 . . . . 0.0 110.784 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.447 HG21 ' HG2' ' A' ' 20' ' ' ARG . 1.4 p -147.02 142.2 27.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.378 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -152.91 140.34 19.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -107.76 129.36 55.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.936 -177.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -126.84 101.2 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.373 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' MET . . . . . 0.504 ' SD ' HD23 ' A' ' 31' ' ' LEU . 65.9 mtt 56.05 32.98 21.03 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.666 176.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.35 -24.76 26.76 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.324 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.09 118.6 21.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 20.5 m -100.05 105.45 17.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.178 0.513 . . . . 0.0 111.053 -176.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.49 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 95.2 m-85 -92.44 153.25 19.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.016 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HG2' HG21 ' A' ' 11' ' ' THR . 83.3 mtt85 -133.57 153.91 51.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.412 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.463 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.51 111.06 0.8 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.994 0.426 . . . . 0.0 111.218 176.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.8 6.37 67.52 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.636 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 87.9 t -114.55 110.32 31.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.04 0.448 . . . . 0.0 111.139 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.51 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 24.8 p -86.7 114.94 23.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.686 174.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -110.51 159.27 17.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.457 HG21 ' SD ' ' A' ' 1' ' ' MET . 12.4 p -67.45 135.23 52.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.949 0.404 . . . . 0.0 112.022 -175.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.44 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 31.4 m -129.76 144.08 51.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.188 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.518 ' HD2' HD11 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -66.21 167.89 17.23 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 123.24 2.626 . . . . 0.0 112.211 174.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -55.66 -40.28 72.05 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.421 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -75.57 -34.15 60.66 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.227 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.518 HD11 ' HD2' ' A' ' 28' ' ' PRO . 34.9 mt -75.99 -25.6 55.94 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.036 -179.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.48 -42.88 97.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.962 0.41 . . . . 0.0 110.087 176.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.96 -38.06 46.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.53 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -57.5 -43.5 84.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.467 ' HB2' HD23 ' A' ' 43' ' ' LEU . 92.3 mt -84.72 -20.22 31.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.982 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -62.3 -36.6 82.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.357 0.598 . . . . 0.0 109.978 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 24.85 3.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.43 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -116.8 121.77 32.41 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.847 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.62 -32.63 93.56 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.274 2.649 . . . . 0.0 114.238 -174.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.438 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 6.1 p90 -99.24 23.27 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -131.16 120.34 23.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 111.453 175.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.516 HG13 HD13 ' A' ' 7' ' ' ILE . 71.4 mt -106.21 111.43 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.467 HD23 ' HB2' ' A' ' 35' ' ' LEU . 5.4 mp -91.8 169.14 10.94 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.8 m -152.67 128.74 10.39 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.89 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -89.1 135.87 33.33 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 0.0 110.271 177.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -101.52 -174.9 2.71 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.572 178.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.93 157.1 35.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.067 0.46 . . . . 0.0 110.71 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.427 ' C ' HD21 ' A' ' 48' ' ' ASN . 0.2 OUTLIER -79.5 -41.51 27.24 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.251 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.9 m120 64.29 -176.92 0.16 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.652 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -98.95 164.49 12.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 64.89 24.43 12.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.117 0.484 . . . . 0.0 110.402 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -66.77 -37.51 84.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.732 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -126.97 91.89 45.8 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.042 169.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.53 ' O ' HG23 ' A' ' 73' ' ' ILE . 7.0 Cg_exo -72.74 105.01 1.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 123.099 2.533 . . . . 0.0 112.182 -176.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.561 HD12 HG22 ' A' ' 94' ' ' ILE . 11.0 tp 178.32 26.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 121.951 0.881 . . . . 0.0 109.763 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.467 ' HA ' HD12 ' A' ' 98' ' ' ILE . 25.2 p-10 -142.48 38.22 1.52 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.567 -170.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.616 ' HB2' HD23 ' A' ' 62' ' ' LEU . 75.2 m-85 -96.64 165.64 12.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.945 0.402 . . . . 0.0 111.482 -175.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.517 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 14.3 m -64.37 138.17 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.194 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -51.28 -54.1 29.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.12 0.485 . . . . 0.0 109.774 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.4 t -59.34 -34.43 72.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.731 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.643 ' HG2' ' HE1' ' A' ' 65' ' ' MET . 34.6 tt0 -71.79 -42.13 67.48 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.055 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.616 HD23 ' HB2' ' A' ' 57' ' ' TYR . 80.8 mt -65.37 -40.9 94.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.325 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.628 ' HG3' HG12 ' A' ' 91' ' ' ILE . 98.7 mttt -68.22 -17.17 64.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.033 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.54 11.14 42.64 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.237 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.643 ' HE1' ' HG2' ' A' ' 61' ' ' GLU . 45.9 mtt -89.13 162.19 16.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.0 111.528 -179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.706 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 45.6 t-20 -71.2 145.98 49.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.202 174.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 14.2 tmtt? -53.69 -39.35 65.08 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.603 177.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.99 -28.03 67.93 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.742 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.706 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 23.1 mm-40 -64.35 -50.16 68.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.699 ' O ' HG12 ' A' ' 74' ' ' ILE . 64.8 m-70 -55.45 -42.49 74.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.916 176.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 45.6 mt-10 -58.51 -51.56 69.34 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.388 0.43 . . . . 0.0 110.352 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m -55.03 -42.11 72.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.509 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.53 HG23 ' O ' ' A' ' 54' ' ' PRO . 88.2 mt -57.7 -60.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.509 178.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.699 HG12 ' O ' ' A' ' 70' ' ' HIS . 3.1 pt -76.24 -13.92 14.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -174.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.7 m -72.59 -45.22 60.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -74.39 -30.2 61.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.467 HD23 HD11 ' A' ' 55' ' ' ILE . 33.4 tp -67.63 -34.2 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.41 36.06 3.67 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.17 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.565 ' HB3' ' HB ' ' A' ' 74' ' ' ILE . 30.7 tpt180 -115.55 -50.92 2.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.573 0.225 . . . . 0.0 110.523 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.6 t30 68.08 134.12 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.452 0 O-C-N 124.028 0.83 . . . . 0.0 111.16 -177.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.52 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 20.4 Cg_endo -81.05 61.98 8.39 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.457 2.105 . . . . 0.0 112.506 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.7 p -86.42 -17.81 33.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.549 -179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -149.77 81.76 1.39 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 110.607 175.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.425 ' CD2' ' HA ' ' A' ' 81' ' ' PRO . 85.3 m-85 -142.27 108.57 5.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.15 174.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -102.67 -28.07 12.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.084 -175.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.569 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 84.0 m-20 -107.11 152.69 23.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.757 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.58 -37.65 73.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -55.16 -41.49 71.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.707 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.569 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 48.2 mm-40 -59.88 -45.42 92.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.171 177.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -62.53 -46.79 86.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.628 HG12 ' HG3' ' A' ' 63' ' ' LYS . 1.9 mp -66.52 -40.38 86.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.421 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.15 -40.53 90.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.493 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -71.04 -37.3 72.55 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.851 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.561 HG22 HD12 ' A' ' 55' ' ' ILE . 64.1 mt -70.72 -37.95 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.552 179.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.431 HD11 HD11 ' A' ' 98' ' ' ILE . 3.9 mm? -71.98 -18.71 61.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.133 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -60.9 -43.73 98.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -69.95 -37.35 75.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.661 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.467 HD12 ' HA ' ' A' ' 56' ' ' ASN . 64.2 mt -64.34 -41.61 92.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.56 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -68.82 -37.08 78.97 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.606 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.2 -54.68 22.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.775 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -101.64 24.04 10.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 110.984 -173.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -102.8 -13.86 28.6 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.0 -178.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -82.96 91.17 7.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.629 0.728 . . . . 0.0 111.716 -176.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.5 mp -126.5 -89.01 0.56 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.07 174.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -88.56 -41.81 12.46 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.73 142.15 51.47 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 58.1 t60 60.23 47.29 9.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -174.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -56.96 137.79 55.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.078 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -76.25 3.4 10.88 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -171.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -171.53 128.73 0.67 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 38.6 p-80 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.214 -179.461 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.0 mtp . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 121.191 0.52 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 26' ' ' THR . 56.0 m-85 -111.34 130.15 55.77 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 25' ' ' GLN . 14.3 p -113.59 123.08 49.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.956 0.408 . . . . 0.0 110.823 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.98 135.06 49.19 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.136 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 28.7 ttpp -126.53 122.78 36.11 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.42 -178.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -63.95 117.4 6.96 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.735 HG13 ' HG3' ' A' ' 8' ' ' LYS . 33.7 pt -106.12 -27.21 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.593 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.735 ' HG3' HG13 ' A' ' 7' ' ' ILE . 29.9 mtpp -117.36 100.58 7.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.334 -177.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.8 -120.92 1.82 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.567 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.483 ' HG3' ' H ' ' A' ' 11' ' ' THR . 20.8 pttp -176.21 -56.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -174.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.483 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.5 p -142.21 119.22 11.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.206 -178.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -154.51 124.2 6.61 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.55 135.92 49.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.998 0.428 . . . . 0.0 110.631 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.406 HG23 HD23 ' A' ' 35' ' ' LEU . 58.5 t -107.3 107.03 21.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.944 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.9 mtt 65.66 -75.25 0.05 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.972 0.795 . . . . 0.0 111.334 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -138.76 -3.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.82 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.455 HD11 ' N ' ' A' ' 17' ' ' ILE . 4.1 mp -101.15 115.32 42.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -91.05 112.14 23.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.155 -174.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.44 153.81 19.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.269 0.556 . . . . 0.0 111.322 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -131.79 150.98 51.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.427 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -57.91 111.65 1.23 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.769 0.319 . . . . 0.0 110.841 175.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.76 -8.66 43.35 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.543 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -104.3 119.39 53.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.809 0.338 . . . . 0.0 110.654 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 20.4 p -102.72 123.08 45.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.204 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 3' ' ' THR . 48.9 mt-30 -127.65 157.78 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.655 0.265 . . . . 0.0 111.134 -178.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 0.8 OUTLIER -71.83 128.81 36.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.605 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 34.1 m -123.95 145.84 49.14 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.684 178.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.526 ' HD2' HD13 ' A' ' 31' ' ' LEU . 26.0 Cg_exo -63.5 156.89 53.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.711 2.274 . . . . 0.0 111.356 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -53.94 -36.07 62.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.53 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.45 -44.68 95.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.526 HD13 ' HD2' ' A' ' 28' ' ' PRO . 76.4 mt -78.26 -26.81 47.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.764 0.316 . . . . 0.0 110.613 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -57.63 -48.33 79.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.391 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -77.1 -30.76 55.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.041 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -61.31 -46.15 91.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.107 176.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.406 HD23 HG23 ' A' ' 14' ' ' VAL . 82.8 mt -77.97 -19.55 54.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.247 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -65.53 -28.08 68.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.31 0.576 . . . . 0.0 110.079 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -90.64 10.64 24.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.951 176.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -135.02 97.44 13.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.359 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -71.81 28.07 0.24 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.788 2.992 . . . . 0.0 114.904 -169.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.445 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.7 p90 -112.37 9.65 19.81 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.484 -0.487 . . . . 0.0 111.044 175.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.409 ' CZ ' HD22 ' A' ' 6' ' ' LEU . 42.9 m-85 -123.64 140.99 52.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.342 171.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.452 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.8 tt -97.18 126.66 49.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 171.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.01 103.98 13.63 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.623 -174.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.9 m -106.26 125.04 50.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.417 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -105.44 106.27 16.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.339 0.59 . . . . 0.0 109.639 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -101.16 105.36 16.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.016 -172.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.2 mt -119.7 102.21 8.44 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.313 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -151.01 113.91 4.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.979 -177.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.401 ' HB3' ' H ' ' A' ' 50' ' ' GLN . 37.7 m-80 59.66 -161.5 0.27 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.626 174.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.401 ' H ' ' HB3' ' A' ' 49' ' ' ASN . 48.5 mt-30 -145.02 -60.85 0.36 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.502 -172.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -80.41 32.78 0.29 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.529 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -90.76 -13.15 34.53 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.99 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -148.72 96.08 3.87 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.479 ' O ' HG23 ' A' ' 55' ' ' ILE . 98.3 Cg_endo -88.26 169.03 6.23 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 123.07 2.513 . . . . 0.0 113.121 -176.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.493 HD12 ' HG3' ' A' ' 97' ' ' GLN . 7.2 tp 52.61 25.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.433 1.093 . . . . 0.0 111.738 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -157.02 92.66 1.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.988 -175.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -142.77 159.95 41.26 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.485 HG21 ' H ' ' A' ' 60' ' ' SER . 3.2 m -67.98 145.03 54.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.055 174.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.404 ' HB2' HD11 ' A' ' 95' ' ' LEU . 2.4 tm-20 -56.54 -31.64 64.34 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 171.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.485 ' H ' HG21 ' A' ' 58' ' ' THR . 14.9 m -60.05 -38.75 83.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.456 172.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.26 -36.25 24.69 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.21 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.0 mt -72.76 -16.86 61.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.41 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.571 ' HD2' HD13 ' A' ' 91' ' ' ILE . 0.6 OUTLIER -63.45 -36.03 82.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.453 176.663 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.43 -135.23 5.2 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.068 -176.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm 61.77 -166.88 0.21 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 122.896 0.478 . . . . 0.0 110.124 -173.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -106.26 162.2 13.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.454 ' HE2' ' HB2' ' A' ' 67' ' ' LYS . 3.5 mppt? -69.63 -33.44 72.63 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 121.343 -0.143 . . . . 0.0 110.73 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.37 -46.04 46.63 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.793 0.683 . . . . 0.0 112.394 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.6 mp0 -57.63 -55.99 27.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 110.068 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.532 ' HA ' HD13 ' A' ' 73' ' ' ILE . 69.3 m-70 -55.58 -47.75 75.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.998 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.49 -50.97 70.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.424 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.4 m -56.93 -37.83 72.03 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.316 0.579 . . . . 0.0 110.825 -178.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.532 HD13 ' HA ' ' A' ' 70' ' ' HIS . 88.0 mt -60.8 -60.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.544 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.479 ' HB ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -70.18 -29.04 38.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.113 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.491 ' HA ' ' OD1' ' A' ' 80' ' ' ASN . 13.6 p -67.17 -32.78 74.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.839 0.352 . . . . 0.0 110.659 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -87.46 -18.05 30.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.878 0.37 . . . . 0.0 110.942 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.8 -37.75 67.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.045 175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 126.25 -13.71 7.02 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.208 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.479 ' O ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -113.93 80.35 1.37 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.206 0.527 . . . . 0.0 110.244 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.491 ' OD1' ' HA ' ' A' ' 75' ' ' SER . 77.2 m-20 -52.64 139.72 39.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.101 178.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.485 ' HA ' ' HB2' ' A' ' 84' ' ' PHE . 61.1 Cg_endo -75.3 51.19 2.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.976 2.451 . . . . 0.0 113.006 -178.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.6 m -71.13 -51.06 27.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.874 0.369 . . . . 0.0 110.504 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -100.37 -6.22 26.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.122 0.486 . . . . 0.0 110.429 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.485 ' HB2' ' HA ' ' A' ' 81' ' ' PRO . 97.2 m-85 -90.79 108.66 19.97 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -145.2 -39.21 0.25 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.137 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.75 139.96 57.84 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.562 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 90' ' ' ARG . . . -52.55 -52.89 52.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -74.63 -25.5 59.27 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.691 -174.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.84 -39.84 76.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.438 0.637 . . . . 0.0 109.978 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 87' ' ' ALA . 12.1 ttm180 -54.48 -54.2 44.07 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.417 174.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.571 HD13 ' HD2' ' A' ' 63' ' ' LYS . 47.4 mt -61.67 -42.66 95.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.685 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.11 74.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.867 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -65.45 -48.17 73.62 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.865 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.27 -34.91 72.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.511 -176.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.404 HD11 ' HB2' ' A' ' 59' ' ' GLU . 29.2 mt -65.7 -39.45 91.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.008 176.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -68.63 -17.34 64.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.199 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.493 ' HG3' HD12 ' A' ' 55' ' ' ILE . 29.8 mm-40 -73.43 -24.8 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 176.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -86.59 -47.19 16.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.348 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.3 -46.85 75.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.395 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -87.2 91.53 8.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.094 0.473 . . . . 0.0 110.053 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -147.76 -11.42 0.39 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.894 -178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 118.57 75.36 0.49 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.779 177.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -75.85 94.79 3.39 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 172.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.8 tp -117.09 107.76 14.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.341 -174.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -127.47 -35.43 2.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.94 174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -111.2 120.55 42.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.262 -165.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.425 ' HB2' ' OXT' ' A' ' 111' ' ' HIS . 12.8 p-80 -81.37 168.94 17.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.759 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -85.02 -51.75 6.45 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.689 0.281 . . . . 0.0 111.013 -175.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -158.66 -83.12 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -90.78 -36.25 14.37 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.425 ' OXT' ' HB2' ' A' ' 107' ' ' HIS . 69.3 m-70 . . . . . 0 C--O 1.245 0.822 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.589 167.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 N--CA 1.484 1.233 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -107.11 131.3 54.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.882 0.373 . . . . 0.0 110.221 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.5 m -138.62 127.47 23.71 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.381 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.95 138.88 44.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' HD3' ' OG ' ' A' ' 24' ' ' SER . 34.9 ttpt -129.79 116.51 18.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -65.9 124.96 23.91 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.729 HG13 ' HG3' ' A' ' 8' ' ' LYS . 18.7 pt -117.18 -38.31 2.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.369 . . . . 0.0 111.319 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.729 ' HG3' HG13 ' A' ' 7' ' ' ILE . 61.5 mtpt -100.67 90.66 4.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.058 0.456 . . . . 0.0 110.243 -177.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.43 -137.22 6.47 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.697 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.429 ' HB3' ' HE2' ' A' ' 10' ' ' LYS . 46.0 mtpt -154.25 -55.62 0.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.1 m -149.88 131.86 15.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.058 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -143.21 123.68 13.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.1 -177.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -85.17 117.58 24.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.93 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.0 t -114.41 106.25 20.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 176.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.73 -91.37 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.845 -177.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.98 6.79 6.43 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.8 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.462 ' N ' HD13 ' A' ' 17' ' ' ILE . 4.0 mp -108.89 129.74 62.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -98.61 105.81 18.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.97 0.414 . . . . 0.0 110.878 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -87.49 143.51 27.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.487 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -133.9 144.22 48.74 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.288 178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -50.02 119.32 3.5 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.628 0.58 . . . . 0.0 112.033 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 -4.67 63.48 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.591 -0.731 . . . . 0.0 113.266 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -106.74 114.15 45.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 117.112 0.456 . . . . 0.0 111.669 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.409 ' OG ' ' HD3' ' A' ' 5' ' ' LYS . 41.4 m -79.12 130.97 36.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.107 171.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -129.78 139.3 51.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.772 0.32 . . . . 0.0 110.76 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -72.62 108.61 5.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 m -109.37 154.68 42.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.175 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.5 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.2 Cg_exo -67.37 164.39 30.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.955 2.436 . . . . 0.0 111.866 174.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -58.01 -40.04 79.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.564 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.47 -48.91 73.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.463 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.5 HD12 ' HD2' ' A' ' 28' ' ' PRO . 59.1 mt -67.47 -27.37 66.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.171 -176.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -58.9 -48.38 81.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.847 0.356 . . . . 0.0 110.137 175.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.39 -37.36 63.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.749 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.401 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 80.5 t80 -55.82 -42.98 76.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.734 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.495 HD21 ' CE1' ' A' ' 41' ' ' PHE . 87.2 mt -85.75 -18.96 31.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.991 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -61.48 -30.86 70.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.347 0.594 . . . . 0.0 109.838 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -82.81 -0.52 48.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.745 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -121.23 114.43 31.98 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.897 0.379 . . . . 0.0 110.951 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -78.16 44.58 1.62 Allowed 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 123.149 2.566 . . . . 0.0 113.542 -173.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -105.16 -15.53 15.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 110.297 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.495 ' CE1' HD21 ' A' ' 35' ' ' LEU . 35.9 m-85 -123.08 153.45 39.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.402 -167.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.514 HG12 HD11 ' A' ' 7' ' ' ILE . 25.9 mm -101.57 108.61 23.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 162.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -90.02 118.64 29.72 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.278 0.561 . . . . 0.0 110.083 -177.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 m -100.87 116.29 32.39 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.211 -175.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -89.85 112.41 23.75 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -101.49 149.45 24.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.156 0.503 . . . . 0.0 111.052 -170.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 72.2 mt -73.96 131.92 41.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.638 -169.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -104.5 4.16 32.79 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 165.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -78.65 -12.5 60.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.007 -171.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 50' ' ' GLN . 14.5 pt20 -73.03 89.99 1.48 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.406 0.622 . . . . 0.0 110.879 -178.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -135.47 63.9 1.59 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.369 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.95 -27.93 61.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.344 177.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 57.84 84.62 0.2 Allowed Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.867 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.509 ' O ' HG22 ' A' ' 55' ' ' ILE . 84.6 Cg_endo -94.31 146.83 1.87 Allowed 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.948 2.432 . . . . 0.0 112.912 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.792 HG23 HD13 ' A' ' 77' ' ' LEU . 3.8 tp 59.41 23.75 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 115.305 -0.861 . . . . 0.0 113.049 169.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -136.64 38.49 2.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.211 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.464 ' HB2' HD23 ' A' ' 62' ' ' LEU . 68.6 m-85 -94.92 155.94 16.55 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.569 -178.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.564 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -57.53 127.01 29.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.748 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.745 ' HB3' ' HG ' ' A' ' 95' ' ' LEU . 1.9 pp20? -62.79 -26.19 68.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.142 0.496 . . . . 0.0 110.289 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 p -71.59 -30.73 66.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.948 174.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.564 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 30.3 mm-40 -79.49 -40.7 29.12 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.561 175.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' ' 57' ' ' TYR . 92.3 mt -62.96 -20.93 65.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.153 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.596 ' HD3' HD11 ' A' ' 91' ' ' ILE . 0.1 OUTLIER -64.69 -33.46 76.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.916 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.95 -24.04 13.9 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.536 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 24.1 mmt -53.89 138.51 36.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.919 0.39 . . . . 0.0 110.99 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -84.47 -174.79 5.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.298 0.57 . . . . 0.0 111.836 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 63.2 tttm -59.34 -54.41 47.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.421 -178.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.59 84.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.795 -174.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 73' ' ' ILE . 49.1 mt-10 -63.99 -51.46 64.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.517 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.56 ' O ' HG13 ' A' ' 74' ' ' ILE . 26.7 m-70 -55.31 -43.11 74.56 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.095 175.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.565 ' HG2' ' HG2' ' A' ' 81' ' ' PRO . 46.0 mt-10 -60.17 -45.23 93.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.963 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -65.21 -45.04 86.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.744 0.307 . . . . 0.0 110.475 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 69' ' ' GLU . 97.8 mt -55.37 -56.54 11.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.993 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.1 mt -75.02 -25.75 18.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.065 -172.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.9 m -71.56 -27.18 62.98 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.111 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -69.88 -33.25 71.97 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 171.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.792 HD13 HG23 ' A' ' 55' ' ' ILE . 42.3 tp -67.17 -37.64 84.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.182 173.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 123.03 22.4 2.4 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.877 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -146.74 126.09 13.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 111.217 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.43 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 17.2 m120 -80.09 137.6 53.18 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.122 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.565 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 8.7 Cg_endo -84.39 48.68 2.52 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.599 2.199 . . . . 0.0 112.237 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.1 p -85.95 -36.08 20.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.656 175.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -66.3 -35.56 80.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.128 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -96.03 108.65 21.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.302 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -94.45 -26.41 16.49 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.993 0.425 . . . . 0.0 110.783 -174.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.497 ' HB3' ' CD ' ' A' ' 89' ' ' GLU . 3.7 t-20 -99.09 151.34 21.07 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.107 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -65.36 -32.68 74.44 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -177.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.38 -55.63 32.31 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.589 0.233 . . . . 0.0 111.386 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.497 ' CD ' ' HB3' ' A' ' 86' ' ' ASN . 1.1 pm0 -60.5 -34.25 73.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.284 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.43 ' O ' HG13 ' A' ' 94' ' ' ILE . 97.5 mtt180 -64.6 -44.24 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.429 177.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.596 HD11 ' HD3' ' A' ' 63' ' ' LYS . 80.7 mt -66.05 -44.87 91.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.127 177.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.33 96.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.5 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.54 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 49.2 t80 -64.4 -42.36 96.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.455 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -69.73 -40.79 79.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 0.0 110.134 177.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.745 ' HG ' ' HB3' ' A' ' 59' ' ' GLU . 0.5 OUTLIER -57.66 -46.1 84.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.813 -179.623 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -76.42 -3.84 39.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -174.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.636 ' HG3' HG12 ' A' ' 55' ' ' ILE . 76.3 mm-40 -80.17 -30.15 38.8 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.4 mt -74.72 -34.88 35.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.591 174.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.1 -42.33 60.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.779 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -104.73 71.82 1.0 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.393 0.616 . . . . 0.0 110.205 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -111.85 116.09 30.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.951 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.81 110.93 3.05 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.842 176.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -98.13 37.69 1.41 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.512 0.672 . . . . 0.0 109.544 177.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.525 HD13 ' HB3' ' A' ' 108' ' ' HIS . 57.9 mt -93.54 147.02 23.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.855 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.57 -64.16 1.35 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -174.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -102.86 71.23 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -172.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 41.0 m80 57.26 23.18 8.47 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.391 174.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.525 ' HB3' HD13 ' A' ' 104' ' ' LEU . 8.4 p80 59.01 157.84 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.791 1.236 . . . . 0.0 113.417 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 46.0 t60 -88.09 152.09 22.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.604 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -99.53 -80.66 0.47 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 . . . . . 0 C--O 1.242 0.672 0 CA-C-O 118.799 -0.619 . . . . 0.0 109.651 177.323 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 40.4 m-85 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 t -144.14 146.23 32.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.969 0.414 . . . . 0.0 110.604 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.54 145.68 51.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.389 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -134.78 129.62 34.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.915 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.784 HD22 ' H ' ' A' ' 9' ' ' GLY . 2.8 mt -64.09 117.8 7.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -177.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.494 HG21 ' HB ' ' A' ' 42' ' ' ILE . 42.5 pt -108.39 -28.51 2.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.15 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 40' ' ' TYR . 49.1 tptt -88.91 -34.33 16.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.11 -177.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.784 ' H ' HD22 ' A' ' 6' ' ' LEU . . . -105.13 -157.77 23.06 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.672 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 73.3 mmtt -139.9 -41.76 0.43 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.464 HG23 ' HG2' ' A' ' 20' ' ' ARG . 25.4 m -152.34 114.4 4.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.88 172.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CB ' HD11 ' A' ' 6' ' ' LEU . 29.6 t80 -136.31 139.14 42.39 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.685 0.278 . . . . 0.0 110.358 -172.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -106.95 112.39 25.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.962 0.411 . . . . 0.0 110.271 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 35' ' ' LEU . 78.8 t -102.09 104.34 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 45.2 ttm 65.71 -79.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.742 0.651 . . . . 0.0 110.668 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.38 10.92 2.74 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.1 mm -108.03 139.63 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 m -108.95 113.27 26.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.929 0.395 . . . . 0.0 111.137 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -107.4 148.86 28.56 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.239 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 11' ' ' THR . 31.2 mtp85 -133.01 143.29 49.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 175.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 9' ' ' GLY . . . -55.28 127.21 28.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.955 0.407 . . . . 0.0 111.317 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.83 -13.28 67.79 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.162 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -103.77 113.49 40.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.703 0.287 . . . . 0.0 110.842 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.3 m -85.53 136.3 33.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -138.05 134.32 34.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -70.39 130.55 42.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.52 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 34.0 m -126.74 155.43 75.14 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.881 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.543 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.2 Cg_exo -70.88 166.69 28.15 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.855 2.37 . . . . 0.0 111.469 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -56.7 -36.91 70.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -56.33 -51.16 69.27 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.035 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.543 HD12 ' HD2' ' A' ' 28' ' ' PRO . 83.0 mt -73.77 -30.11 62.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.044 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -59.16 -46.85 87.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.584 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -80.55 -27.2 37.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.33 -41.76 98.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 173.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 41' ' ' PHE . 79.4 mt -85.33 -8.21 58.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.605 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.431 ' HA ' HD11 ' A' ' 43' ' ' LEU . 15.4 t30 -72.12 -32.2 66.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 172.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -75.98 -39.03 56.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.728 172.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.601 ' HB3' ' HD1' ' A' ' 40' ' ' TYR . 33.1 m-80 -86.44 108.9 19.69 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.548 -175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.18 44.84 1.68 Allowed 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.072 2.514 . . . . 0.0 113.541 -174.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.601 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 63.0 m-85 -102.41 -16.65 16.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 110.951 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.497 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 64.4 m-85 -125.35 158.84 33.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.004 0.431 . . . . 0.0 111.61 -169.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.494 ' HB ' HG21 ' A' ' 7' ' ' ILE . 15.8 tt -97.05 131.64 43.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 165.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.431 HD11 ' HA ' ' A' ' 36' ' ' ASN . 69.8 mt -108.58 134.41 51.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.398 0.618 . . . . 0.0 111.091 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.7 m . . . . . 0 C--N 1.317 -0.81 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.69 -179.978 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' A' ' 76' ' ' ASN . 56.6 Cg_endo . . . . . 0 N--CA 1.454 -0.806 0 CA-C-O 121.022 0.343 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.758 HG12 HD22 ' A' ' 77' ' ' LEU . 8.5 tp -169.65 27.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 122.247 1.022 . . . . 0.0 109.438 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -160.54 109.43 1.67 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.016 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -142.07 174.84 10.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.497 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -64.17 129.43 39.94 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.3 pp20? -60.27 -31.32 70.11 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -62.02 -37.95 86.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.119 174.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -29.6 42.84 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 120.566 -0.453 . . . . 0.0 110.39 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 65' ' ' MET . 92.1 mt -79.9 -20.25 46.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.102 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 30.2 mmtp -68.04 -30.96 70.31 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.278 0.561 . . . . 0.0 109.962 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.49 26.17 13.77 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.621 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.595 ' HG3' ' HB2' ' A' ' 69' ' ' GLU . 44.0 tpp -104.29 135.48 45.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.703 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 5.6 m-20 -71.92 170.03 14.62 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.782 0.801 . . . . 0.0 112.958 -171.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -58.21 8.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.769 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.45 -24.66 65.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.916 0.389 . . . . 0.0 111.126 -175.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.703 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 8.7 mm-40 -65.04 -54.08 35.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.998 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.527 ' O ' HG13 ' A' ' 74' ' ' ILE . 44.0 m-70 -53.66 -40.66 66.08 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 176.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.97 -49.22 62.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.623 -176.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 p -61.08 -35.83 78.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.63 0.252 . . . . 0.0 110.874 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 69' ' ' GLU . 94.0 mt -55.7 -61.6 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.104 0.478 . . . . 0.0 110.91 175.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.63 ' HA ' HD13 ' A' ' 55' ' ' ILE . 5.7 mt -70.93 -21.38 22.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -173.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 57.9 m -67.7 -35.08 78.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.843 0.354 . . . . 0.0 110.237 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.562 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 17.9 m-80 -72.13 -28.32 63.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.406 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.758 HD22 HG12 ' A' ' 55' ' ' ILE . 42.0 tp -64.43 -34.86 79.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.349 172.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 19.43 10.5 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.924 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 159.64 20.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -95.23 107.16 30.49 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.852 0.358 . . . . 0.0 110.627 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.525 ' HB3' HD12 ' A' ' 74' ' ' ILE . 83.9 Cg_endo -82.91 12.78 2.83 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.333 . . . . 0.0 112.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.6 p -77.89 -25.74 48.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.24 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.77 -37.54 59.16 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.087 0.47 . . . . 0.0 109.879 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -81.98 108.59 15.6 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -105.29 -29.59 10.2 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -170.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -89.68 153.24 20.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.84 0.353 . . . . 0.0 110.601 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.8 91.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -54.64 -48.79 71.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.94 -50.51 73.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.409 0.623 . . . . 0.0 110.807 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -67.24 -39.94 86.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.016 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.403 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.3 mt -70.05 -44.24 78.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.681 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.02 -42.4 99.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 0.0 111.335 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.24 -40.55 96.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.51 -34.89 71.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 178.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.632 ' O ' HG22 ' A' ' 98' ' ' ILE . 53.3 mt -67.36 -23.7 65.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.567 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -30.18 71.3 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.318 176.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 55' ' ' ILE . 2.2 mp0 -88.27 -25.07 23.01 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.395 -178.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 95' ' ' LEU . 8.3 tp -70.47 -22.18 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 173.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.405 173.767 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 85.1 m -112.74 130.36 56.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.205 0.526 . . . . 0.0 111.314 -174.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -114.21 146.1 40.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.176 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.408 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 36.1 ttpt -133.97 129.62 36.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.387 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -67.78 118.94 11.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.677 HG13 ' HG3' ' A' ' 8' ' ' LYS . 38.4 pt -109.25 -25.66 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.591 -176.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.677 ' HG3' HG13 ' A' ' 7' ' ' ILE . 99.2 mttt -122.06 96.79 5.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 0.0 111.115 -177.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.22 -118.52 0.99 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.878 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 2.2 ttmp? -175.61 -58.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.469 HG22 ' HG2' ' A' ' 20' ' ' ARG . 4.0 p -141.26 118.11 11.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.28 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -136.35 133.41 36.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.918 0.389 . . . . 0.0 110.634 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -97.24 110.5 23.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.892 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.83 92.01 3.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 173.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 35.1 mtm 62.78 -86.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.688 -176.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -124.23 12.54 8.02 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.536 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.8 mp -120.46 125.3 73.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.734 0.267 . . . . 0.0 110.478 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.4 m -89.95 109.36 20.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.516 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.469 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 81.0 m-85 -92.83 131.2 38.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.995 176.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HG2' HG22 ' A' ' 11' ' ' THR . 80.7 mtt180 -114.79 143.72 44.63 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.22 115.03 2.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.184 178.281 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.16 -9.49 59.58 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.837 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.9 t -100.72 115.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.881 0.372 . . . . 0.0 110.969 -178.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m -84.95 136.32 33.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.308 176.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.415 ' C ' HG23 ' A' ' 3' ' ' THR . 97.4 mt-30 -141.08 128.21 20.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.208 -177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.5 m -72.72 127.13 31.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.821 0.343 . . . . 0.0 110.273 178.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 m -118.68 163.43 25.81 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.685 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.7 Cg_exo -69.09 155.76 67.16 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.445 2.096 . . . . 0.0 110.576 169.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -63.94 -24.24 67.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.565 0.221 . . . . 0.0 111.275 -175.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -55.21 -41.45 72.04 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.12 0.486 . . . . 0.0 110.275 171.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.9 mt -84.32 -21.93 30.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.84 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.19 -47.38 80.02 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.95 -36.64 75.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.506 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.86 -39.88 95.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.842 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.7 mt -85.15 -12.08 53.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 178.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -68.26 -33.54 74.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -73.96 -15.1 61.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.953 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -122.44 86.43 48.47 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -71.91 13.59 0.48 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.367 2.711 . . . . 0.0 114.611 -168.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.54 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 15.5 p90 -90.93 14.83 12.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.467 0.651 . . . . 0.0 110.515 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.471 ' CE1' HD22 ' A' ' 35' ' ' LEU . 88.8 m-85 -118.26 148.4 42.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.702 169.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.478 ' HB ' HG21 ' A' ' 7' ' ' ILE . 16.5 tt -97.45 129.88 46.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -107.34 114.63 28.79 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.234 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.6 m . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.64 -176.215 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.641 ' O ' HG23 ' A' ' 73' ' ' ILE . 94.8 Cg_endo . . . . . 0 C--O 1.225 -0.156 0 N-CA-C 113.071 0.373 . . . . 0.0 113.071 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tp -145.06 24.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 122.395 1.093 . . . . 0.0 108.084 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -144.66 94.42 2.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.876 -173.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB2' HD11 ' A' ' 62' ' ' LEU . 77.3 m-85 -141.51 160.6 39.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.235 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.524 HG22 ' H ' ' A' ' 60' ' ' SER . 9.4 m -65.45 126.52 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.005 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -64.61 -26.91 68.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.222 0.534 . . . . 0.0 109.642 177.845 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 58' ' ' THR . 9.2 m -68.72 -30.05 68.6 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.609 175.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 13.3 mm-40 -82.1 -44.21 16.82 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.948 0.404 . . . . 0.0 110.341 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 57' ' ' TYR . 88.1 mt -69.03 -12.69 61.91 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.549 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.7 OUTLIER -67.78 -53.61 25.82 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.472 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.67 57.96 1.89 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.734 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.435 ' HG3' ' HA ' ' A' ' 62' ' ' LEU . 12.0 mmt -120.0 -169.49 1.79 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.583 0.706 . . . . 0.0 111.42 -177.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.482 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 39.0 t30 -100.14 -166.35 1.32 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.829 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.482 ' H ' ' CG ' ' A' ' 66' ' ' ASN . 1.4 ttpm? -100.6 -36.98 8.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.767 0.317 . . . . 0.0 110.561 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.505 ' HA ' ' OE1' ' A' ' 71' ' ' GLU . . . -62.78 -36.45 83.14 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -74.7 -39.39 61.98 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.032 -176.424 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.539 ' HA ' HD12 ' A' ' 73' ' ' ILE . 64.6 m80 -56.1 -42.78 77.33 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 120.621 0.248 . . . . 0.0 110.814 172.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 42.0 mt-10 -60.72 -46.72 89.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.229 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 76' ' ' ASN . 22.8 m -67.77 -31.42 71.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.126 178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 54' ' ' PRO . 30.7 mt -58.44 -57.6 10.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.527 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -86.64 -11.83 11.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.97 -171.735 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 p -81.03 -34.57 32.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 72' ' ' SER . 4.4 t-20 -65.18 -34.58 78.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.608 0.718 . . . . 0.0 109.265 174.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.564 HD21 ' NE2' ' A' ' 97' ' ' GLN . 53.4 tp -63.25 -25.16 68.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.997 175.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.97 11.29 60.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.241 -177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.613 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 1.6 tpm_? -93.0 -35.57 13.2 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 122.9 -0.177 . . . . 0.0 110.832 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 38.3 t30 70.45 108.96 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.721 0.638 . . . . 0.0 111.055 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.558 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 2.9 Cg_exo -75.16 65.17 6.21 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.953 2.435 . . . . 0.0 112.943 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 t -92.37 -29.21 16.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.389 . . . . 0.0 110.631 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.29 -23.96 32.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.259 0.552 . . . . 0.0 111.131 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 59.5 m-85 -82.44 126.73 32.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.878 -172.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -108.76 -57.82 2.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.563 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -89.7 154.34 20.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.445 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -61.04 -30.82 70.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.648 0.261 . . . . 0.0 110.63 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.58 -54.29 39.51 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.311 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.41 -37.38 70.11 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.308 0.575 . . . . 0.0 110.634 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.3 mtt-85 -68.25 -45.74 72.38 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.422 -178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 87' ' ' ALA . 75.4 mt -65.13 -43.67 95.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.621 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.5 80.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.484 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -71.26 -43.42 67.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.209 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 90' ' ' ARG . 91.7 mt -59.45 -43.03 89.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.133 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.525 HD23 HD12 ' A' ' 98' ' ' ILE . 19.1 mt -57.52 -39.04 75.68 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.281 174.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -68.33 -27.58 66.4 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.001 -174.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.564 ' NE2' HD21 ' A' ' 77' ' ' LEU . 0.4 OUTLIER -83.37 -19.56 35.87 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.69 178.425 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.525 HD12 HD23 ' A' ' 95' ' ' LEU . 71.0 mt -67.48 -42.06 86.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 170.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.684 174.839 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.518 ' O ' ' HA ' ' A' ' 26' ' ' THR . 76.3 m-85 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.495 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -104.69 122.27 45.31 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.963 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.65 133.0 56.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.1 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -132.35 133.97 44.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.237 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.567 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 2.8 mt -67.07 125.36 25.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.157 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.661 HG13 ' HG3' ' A' ' 8' ' ' LYS . 32.0 pt -111.64 -15.77 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.109 0.481 . . . . 0.0 110.676 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.661 ' HG3' HG13 ' A' ' 7' ' ' ILE . 67.5 mttm -130.14 134.0 47.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.298 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.96 -124.44 7.52 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.052 175.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -160.99 -59.64 0.05 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.975 0.416 . . . . 0.0 109.937 -171.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.498 HG23 ' HG2' ' A' ' 20' ' ' ARG . 32.6 m -153.08 121.15 6.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.278 -178.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -133.98 126.05 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -98.3 117.98 33.91 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.323 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.701 HG21 HD21 ' A' ' 35' ' ' LEU . 21.4 t -111.91 106.14 20.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.673 -178.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 38.1 tpp 71.38 -1.52 2.73 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.634 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.36 -29.0 3.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.65 -177.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.498 HD13 HD11 ' A' ' 31' ' ' LEU . 2.2 mp -82.44 119.93 32.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.0 m -90.01 114.79 26.71 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.078 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -100.08 143.18 30.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.015 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' A' ' 11' ' ' THR . 51.6 mtm180 -124.28 142.24 51.42 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -53.02 113.64 1.17 Allowed 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.426 0.454 . . . . 0.0 111.377 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.58 -13.99 27.5 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.927 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.1 t -104.69 111.31 33.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.964 0.382 . . . . 0.0 111.602 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.495 ' HB3' HG22 ' A' ' 3' ' ' THR . 20.1 m -79.43 137.03 37.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.586 173.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.22 151.83 44.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.518 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 7.6 p -82.97 124.01 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.187 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 21.3 m -118.37 154.34 52.06 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.927 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 27' ' ' VAL . 15.2 Cg_exo -73.56 173.51 13.75 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.773 2.982 . . . . 0.0 113.348 176.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -49.47 -46.6 48.27 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.667 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.8 mmtm -57.59 -53.8 54.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.095 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 45.5 mt -67.48 -33.88 76.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -175.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -59.69 -40.96 89.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -79.96 -38.37 32.45 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.417 0.627 . . . . 0.0 110.352 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -39.77 91.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.274 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.701 HD21 HG21 ' A' ' 14' ' ' VAL . 91.6 mt -85.06 -19.12 32.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.714 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -62.06 -32.41 72.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.75 175.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -85.7 3.09 42.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.908 176.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -131.17 94.76 26.59 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.78 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.3 34.48 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.452 2.768 . . . . 0.0 114.621 -169.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.538 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.2 p90 -112.5 8.88 19.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.678 0.751 . . . . 0.0 110.515 172.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.453 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 61.1 m-85 -115.01 148.14 39.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.369 168.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.596 ' HB ' HG21 ' A' ' 7' ' ' ILE . 11.2 tp -96.99 122.77 48.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.254 170.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.9 mt -105.01 114.91 29.39 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.862 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--N 1.314 -0.935 0 CA-C-O 121.212 0.529 . . . . 0.0 110.512 -178.582 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.501 ' O ' HG22 ' A' ' 55' ' ' ILE . 5.4 Cg_exo . . . . . 0 N--CA 1.458 -0.579 0 CA-C-O 120.328 0.053 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.534 HG12 HD22 ' A' ' 77' ' ' LEU . 7.6 tp 54.35 26.15 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.315 1.046 . . . . 0.0 112.163 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -148.54 88.42 1.63 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.146 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -142.64 152.62 42.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.947 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 1.016 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.4 m -59.29 130.89 49.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.411 175.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 16.9 pt-20 -61.88 -35.27 77.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.135 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 p -66.57 -30.28 70.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 174.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 1.016 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 55.9 mm-40 -72.54 -39.55 67.41 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.61 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.536 HD23 ' SD ' ' A' ' 65' ' ' MET . 83.2 mt -74.86 -14.46 60.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.386 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 65.3 mmtt -65.12 -47.28 77.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.821 0.343 . . . . 0.0 110.649 177.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.31 53.94 1.8 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.494 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.536 ' SD ' HD23 ' A' ' 62' ' ' LEU . 95.7 mtp -138.09 162.01 35.29 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -94.87 168.54 10.74 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 20.6 pttp -74.28 -27.35 60.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -169.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.07 -49.48 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.2 mp0 -57.94 -51.49 69.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.707 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.505 ' O ' HG13 ' A' ' 74' ' ' ILE . 79.9 m80 -49.89 -40.43 42.84 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.553 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 56.4 mt-10 -65.8 -45.33 82.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.209 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.7 p -74.09 -36.82 64.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.984 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.0 mt -55.09 -59.87 2.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 177.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.52 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 4.6 mt -76.84 -21.6 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -173.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 71' ' ' GLU . 19.3 t -64.43 -33.58 76.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -72.96 -37.32 67.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.175 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.534 HD22 HG12 ' A' ' 55' ' ' ILE . 45.6 tp -59.06 -38.51 79.56 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.434 175.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.41 -43.72 0.87 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.28 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -101.18 107.19 18.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.776 0.322 . . . . 0.0 110.883 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -69.89 124.4 90.57 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.553 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 42.3 Cg_endo -69.05 73.9 1.01 Allowed 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.609 2.206 . . . . 0.0 114.021 -172.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.4 t -104.04 -20.85 13.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.25 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -87.96 8.73 24.98 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.39 0.614 . . . . 0.0 110.174 175.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -119.08 122.83 42.99 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -87.0 -58.9 2.42 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.779 -173.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -92.24 -179.91 5.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 111.434 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.432 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -74.3 -36.59 63.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.679 -176.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -64.33 -38.03 89.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.262 -176.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -58.51 -39.54 80.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.472 ' O ' HG13 ' A' ' 94' ' ' ILE . 77.1 mtt85 -70.4 -40.42 73.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.756 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 87' ' ' ALA . 79.5 mt -63.37 -41.74 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.269 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.67 96.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.219 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -63.91 -38.42 91.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.325 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.478 HG12 HD12 ' A' ' 55' ' ' ILE . 65.8 mt -65.54 -47.52 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 177.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 98' ' ' ILE . 30.4 mt -60.58 -36.37 78.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.953 0.406 . . . . 0.0 111.65 178.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.6 ttpt -63.35 -32.25 73.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.319 -175.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.23 -28.71 47.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 0.0 110.786 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.502 HD12 HD23 ' A' ' 95' ' ' LEU . 63.9 mt -68.23 -40.31 82.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 109.685 175.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.1 t70 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.23 177.637 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.601 0.238 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.8 p -126.22 139.65 53.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.03 136.27 45.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.783 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 5.6 ptpp? -133.25 143.57 49.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.973 0.416 . . . . 0.0 110.775 177.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.691 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -70.76 140.56 51.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.503 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.535 HD13 HG13 ' A' ' 42' ' ' ILE . 43.1 pt -122.82 -43.93 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 67.8 mttm -94.89 94.09 7.83 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.038 0.447 . . . . 0.0 110.462 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.05 -116.04 0.98 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.103 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -179.03 -55.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.9 m -140.57 115.5 9.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.33 176.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -135.87 133.8 38.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 64.5 t30 -102.35 121.61 42.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.091 -176.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.6 t -108.55 106.64 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.214 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.5 mtt 64.48 -85.84 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.993 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -136.19 9.01 4.12 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 121.251 -0.499 . . . . 0.0 111.887 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.462 HD13 HD11 ' A' ' 31' ' ' LEU . 3.8 mp -118.59 112.76 39.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.6 m -88.56 122.94 32.56 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.039 0.447 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -103.36 143.8 32.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.471 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -120.11 146.04 46.33 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.829 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.691 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.53 115.49 2.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.304 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.65 -16.59 60.23 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.693 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -103.28 110.97 31.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.79 0.328 . . . . 0.0 110.208 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.783 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 20.3 m -82.77 136.52 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.253 0.549 . . . . 0.0 111.877 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -114.54 149.41 36.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.436 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -81.68 119.28 23.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 27.7 m -119.44 152.7 53.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.832 0.349 . . . . 0.0 111.574 -173.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.443 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.3 Cg_exo -71.51 177.38 6.84 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.134 2.556 . . . . 0.0 112.087 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.0 -39.51 86.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.469 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -59.37 -52.82 63.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.313 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.538 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 67.3 mt -68.14 -28.91 67.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.393 -175.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 76.8 t80 -60.87 -52.9 63.1 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 177.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -73.47 -31.36 63.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.342 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -61.41 -50.39 73.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.595 ' HB2' HD21 ' A' ' 43' ' ' LEU . 80.1 mt -81.41 -16.9 50.73 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.841 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 56.5 t30 -69.49 -29.54 67.21 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.301 0.572 . . . . 0.0 109.67 175.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.18 -20.85 37.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.568 177.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -94.51 111.35 53.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.433 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.76 29.7 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.262 2.642 . . . . 0.0 114.554 -168.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.513 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.1 p90 -129.21 19.34 5.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.295 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -130.87 136.91 49.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.535 HG13 HD13 ' A' ' 7' ' ' ILE . 4.0 mt -97.8 124.63 50.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.595 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.5 mp -122.07 131.12 53.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.357 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.317 -0.817 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.451 -179.982 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.628 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 57.2 Cg_endo . . . . . 0 N--CA 1.456 -0.718 0 N-CA-C 113.334 0.475 . . . . 0.0 113.334 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.628 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 10.9 tp 163.15 29.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 122.196 0.998 . . . . 0.0 108.569 177.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.525 ' HA ' HD13 ' A' ' 98' ' ' ILE . 27.3 t30 -158.33 89.48 0.98 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.092 -171.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -139.17 164.94 28.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.783 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 60' ' ' SER . 4.6 m -64.74 145.16 56.63 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 172.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -58.88 -37.56 76.86 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 174.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.417 ' H ' HG22 ' A' ' 58' ' ' THR . 16.5 m -63.68 -32.84 74.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.25 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -28.59 62.05 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.319 0.58 . . . . 0.0 110.378 177.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' HB3' HG12 ' A' ' 91' ' ' ILE . 91.4 mt -87.77 -18.82 28.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.259 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -71.06 -43.24 68.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.035 0.445 . . . . 0.0 110.527 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -2.0 90.28 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.922 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.706 ' HG3' ' HG3' ' A' ' 69' ' ' GLU . 49.9 ttm -88.58 131.87 34.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 122.523 0.329 . . . . 0.0 110.34 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.473 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 22.9 m-80 -81.29 175.01 10.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.815 0.34 . . . . 0.0 111.113 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.432 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 19.7 ptmt -67.73 -39.28 84.3 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.07 -53.14 61.43 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.455 -174.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.706 ' HG3' ' HG3' ' A' ' 65' ' ' MET . 3.9 pm0 -65.63 -45.88 81.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.89 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.557 ' O ' HG13 ' A' ' 74' ' ' ILE . 17.4 m-70 -44.53 -53.17 7.31 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.02 -42.63 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.46 -176.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.2 m -61.15 -40.69 94.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.848 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 69' ' ' GLU . 79.8 mt -59.21 -58.66 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.527 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.0 mt -70.8 -24.95 25.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.917 0.389 . . . . 0.0 111.13 -173.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.6 m -68.29 -30.18 69.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.785 0.326 . . . . 0.0 110.233 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -75.17 -26.13 58.84 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.384 175.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 74' ' ' ILE . 50.4 tp -63.02 -32.94 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.495 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.51 5.09 30.1 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.868 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -128.49 99.2 5.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -70.6 129.52 89.94 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.017 -173.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -83.98 43.89 1.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.037 2.492 . . . . 0.0 112.11 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.8 t -70.41 -30.16 66.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.153 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.19 -18.06 35.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 110.588 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -85.47 118.38 24.96 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -111.62 -19.18 12.6 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.86 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 3.5 m-20 -97.45 145.26 26.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.399 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.01 -33.5 75.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.16 -177.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.42 -39.67 77.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.474 ' CD ' ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp0 -60.65 -33.8 73.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.966 0.413 . . . . 0.0 110.274 175.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 71.6 mtt-85 -67.07 -40.6 87.05 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 62' ' ' LEU . 97.0 mt -63.15 -45.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.75 93.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.592 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -70.4 -39.43 74.51 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.635 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -67.79 -34.71 69.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 98' ' ' ILE . 12.8 mt -64.67 -28.62 69.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.887 177.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 96' ' ' LYS . 5.0 tmtm? -77.21 -28.24 53.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.017 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -6.73 58.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.002 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 56' ' ' ASN . 48.0 mm -57.02 -40.27 71.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.674 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 C--O 1.232 0.164 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.935 178.569 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.541 ' HB ' ' HB3' ' A' ' 24' ' ' SER . 17.5 p -108.5 131.67 54.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.026 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.79 148.62 28.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.155 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -147.13 132.43 18.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.2 -174.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 6' ' ' LEU . 2.6 mm? -65.31 125.53 25.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.777 175.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.885 HD12 ' HG3' ' A' ' 8' ' ' LYS . 2.7 pp -109.72 -4.63 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.416 0.626 . . . . 0.0 110.36 175.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.885 ' HG3' HD12 ' A' ' 7' ' ' ILE . 61.8 mttm -138.11 127.38 24.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.997 173.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.69 -128.73 8.44 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.311 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -172.68 -48.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.0 m -152.27 128.95 10.81 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -148.92 133.41 17.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.643 0.259 . . . . 0.0 110.741 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 26.2 t-20 -96.26 123.1 39.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.548 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.5 t -110.54 106.49 20.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.005 177.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 66.35 -74.22 0.06 Allowed 'General case' 0 N--CA 1.466 0.364 0 O-C-N 123.941 0.776 . . . . 0.0 111.363 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.01 -0.36 1.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.683 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.2 mp -113.0 121.01 64.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.7 m -92.93 105.54 17.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.788 0.328 . . . . 0.0 110.653 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -93.73 161.77 14.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.167 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -133.8 154.65 50.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.321 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.45 130.73 45.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.771 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.99 -5.54 84.98 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.688 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.9 t -111.38 107.66 23.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.745 0.307 . . . . 0.0 110.638 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.541 ' HB3' ' HB ' ' A' ' 3' ' ' THR . 13.0 m -85.53 111.62 20.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.396 178.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.93 143.66 42.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.138 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -67.83 128.0 34.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.19 157.42 51.03 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.576 -176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.537 ' HD2' HD12 ' A' ' 31' ' ' LEU . 20.5 Cg_exo -67.31 168.82 16.79 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.27 2.647 . . . . 0.0 112.263 175.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -56.48 -48.9 76.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.804 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -58.45 -47.99 82.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.231 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.537 HD12 ' HD2' ' A' ' 28' ' ' PRO . 42.2 mt -69.29 -27.46 65.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.842 -175.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -57.78 -50.47 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 110.605 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.24 -29.56 38.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.859 0.361 . . . . 0.0 110.558 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 65.5 t80 -63.64 -42.15 98.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.5 mt -82.83 -19.78 36.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -70.52 -23.6 62.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.67 0.747 . . . . 0.0 109.316 173.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -92.69 7.85 41.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.474 176.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -108.35 133.21 20.65 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.278 -177.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.12 -11.76 21.27 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.982 2.455 . . . . 0.0 114.832 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.431 ' CB ' ' HB2' ' A' ' 8' ' ' LYS . 6.9 p90 -118.62 23.71 11.32 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.235 -178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -129.23 119.37 23.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.94 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.614 HD12 HG21 ' A' ' 7' ' ' ILE . 14.4 mt -106.39 125.11 62.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 170.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.12 156.67 19.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--N 1.319 -0.731 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.21 -179.193 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo . . . . . 0 N--CA 1.45 -1.068 0 N-CA-C 114.209 0.811 . . . . 0.0 114.209 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.717 HD11 ' HA ' ' A' ' 94' ' ' ILE . 6.5 tp -178.7 78.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.061 0.934 . . . . 0.0 110.79 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.541 ' OD1' HG13 ' A' ' 98' ' ' ILE . 4.9 t30 -170.15 86.39 0.12 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.801 -176.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.54 ' HB2' HD11 ' A' ' 62' ' ' LEU . 94.4 m-85 -141.39 152.01 43.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.748 0.308 . . . . 0.0 110.925 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.685 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 4.4 m -73.61 143.83 46.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.338 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.545 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 7.0 pt-20 -67.36 -38.71 85.22 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.292 177.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 16.2 m -63.16 -27.58 69.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.291 0.567 . . . . 0.0 109.748 174.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.685 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 39.0 tt0 -78.77 -43.52 25.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.226 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 57' ' ' TYR . 96.6 mt -79.26 -18.33 52.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.013 -178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -62.92 -31.42 72.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.787 0.327 . . . . 0.0 110.337 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -102.0 21.84 40.36 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.899 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 25.0 mmt -107.95 146.34 32.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.845 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.774 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 14.4 m120 -71.3 169.64 14.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 43.3 mtmt -60.41 -50.88 71.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.025 176.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.52 -29.11 67.65 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.659 0.6 . . . . 0.0 111.752 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.774 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 4.9 mm-40 -66.23 -46.38 77.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.705 0.764 . . . . 0.0 109.389 177.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.511 ' HE1' ' O ' ' A' ' 62' ' ' LEU . 51.5 m80 -63.09 -38.94 93.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.103 175.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 42.9 mt-10 -68.29 -34.61 76.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.629 -175.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.8 p -70.42 -34.6 72.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.226 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 69' ' ' GLU . 85.5 mt -58.32 -61.73 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.576 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -73.6 -13.52 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.627 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.4 p -79.49 -32.87 42.53 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.366 -0.534 . . . . 0.0 109.749 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.14 -29.45 65.25 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.165 0.507 . . . . 0.0 109.724 173.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.6 tp -73.23 -26.58 61.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.648 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.77 -6.14 67.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.255 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.591 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -73.11 -36.74 66.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.787 0.327 . . . . 0.0 110.199 -179.757 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' ARG . 45.9 m-80 72.38 137.64 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.171 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.488 ' HA ' HD12 ' A' ' 74' ' ' ILE . 6.1 Cg_endo -78.49 -4.18 13.96 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.695 2.263 . . . . 0.0 113.237 -175.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.44 -10.78 57.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.937 0.399 . . . . 0.0 111.464 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -82.72 -15.02 53.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.241 0.544 . . . . 0.0 110.504 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -119.24 146.68 45.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.754 -173.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.529 ' NZ ' ' HB3' ' A' ' 85' ' ' LYS . 5.4 ttpm? -108.76 -65.04 1.17 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 0.0 110.597 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -76.52 157.48 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.914 -176.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.677 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -63.29 -36.78 84.8 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.18 -49.05 67.47 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.281 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 85' ' ' LYS . 40.7 mt-10 -58.29 -37.75 75.65 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.355 0.598 . . . . 0.0 110.493 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -73.45 -34.03 65.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.613 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 87' ' ' ALA . 22.7 mm -63.4 -50.06 80.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 176.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.68 -45.17 81.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.043 -176.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' A' ' 79' ' ' ARG . 41.3 t80 -67.15 -47.61 70.52 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.457 -176.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.717 ' HA ' HD11 ' A' ' 55' ' ' ILE . 61.6 mt -67.32 -38.97 81.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.969 0.414 . . . . 0.0 110.211 -178.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.545 ' HA ' HG22 ' A' ' 98' ' ' ILE . 4.4 mm? -73.23 -16.71 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.459 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -74.35 -43.46 56.52 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.44 -25.81 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.968 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.545 HG22 ' HA ' ' A' ' 95' ' ' LEU . 14.1 tt -73.31 -14.7 16.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.529 0.68 . . . . 0.0 109.957 175.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.614 178.05 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 . . . . . 0 C--O 1.231 0.12 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.77 131.97 49.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.862 0.363 . . . . 0.0 110.823 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.77 134.26 52.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.429 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -136.65 124.85 23.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.575 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.488 HD23 ' CB ' ' A' ' 19' ' ' PHE . 2.7 mm? -67.57 141.04 56.95 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.28 0.562 . . . . 0.0 111.01 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.556 HG21 HG13 ' A' ' 42' ' ' ILE . 39.1 pt -121.33 -2.4 8.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.473 174.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 95.0 mttt -144.34 149.4 36.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.294 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.39 -28.77 10.1 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.279 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 80.7 tttt 73.78 -37.12 0.36 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.775 0.83 . . . . 0.0 111.504 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.9 m -151.77 123.57 8.0 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -138.88 139.93 38.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 110.387 -174.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -102.9 123.42 46.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.812 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -117.85 102.06 12.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.2 mtt 63.64 -87.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.058 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.17 0.2 6.51 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -105.31 125.33 60.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.8 m -95.65 117.34 30.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.838 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.561 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 95.8 m-85 -107.04 157.54 17.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.768 0.318 . . . . 0.0 110.914 -178.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 20' ' ' ARG . 25.9 mtt180 -124.8 156.3 38.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.835 174.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.441 ' CB ' ' HA ' ' A' ' 10' ' ' LYS . . . -71.88 127.91 34.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.817 0.341 . . . . 0.0 110.599 176.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.9 -4.04 78.1 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.234 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 56.8 t -110.99 108.54 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.778 0.323 . . . . 0.0 110.58 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.8 m -78.34 114.65 17.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.538 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.561 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 42.9 mt-30 -117.36 143.99 45.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 0.0 110.988 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.9 m -72.1 131.29 42.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.861 -175.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 m -136.99 154.98 76.46 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.55 ' HD2' HD12 ' A' ' 31' ' ' LEU . 12.9 Cg_exo -71.05 163.6 38.66 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 111.603 174.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -63.04 -26.78 69.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.465 -176.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -67.67 -36.26 80.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.715 0.293 . . . . 0.0 110.923 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.0 mt -81.1 -31.15 34.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 177.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.539 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 56.7 t80 -60.19 -40.56 90.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.565 174.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -71.16 -43.62 67.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.435 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.23 -40.98 87.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.52 -14.81 51.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.939 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -69.01 -28.8 66.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -86.04 1.76 49.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.087 175.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -121.49 94.49 48.55 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 110.475 -173.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.62 61.89 7.0 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 114.976 -168.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 1.0 OUTLIER -153.22 25.3 0.54 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.261 0.553 . . . . 0.0 110.34 166.571 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -123.98 139.98 53.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.389 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.556 HG13 HG21 ' A' ' 7' ' ' ILE . 11.8 mt -97.2 115.08 35.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 162.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 32.6 mt -99.75 110.14 22.54 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.218 -174.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.71 -175.801 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.427 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 80.5 Cg_endo . . . . . 0 N--CA 1.475 0.419 0 N-CA-C 114.246 0.825 . . . . 0.0 114.246 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.546 HG12 ' HG2' ' A' ' 97' ' ' GLN . 10.5 tp 179.87 29.98 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.017 0.913 . . . . 0.0 109.842 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -150.63 91.47 1.74 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.905 -173.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -142.74 153.47 43.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.672 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.585 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.6 m -62.44 143.1 57.48 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.699 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.86 -34.69 73.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -70.94 -28.78 64.74 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.615 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.585 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 14.2 mm-40 -71.98 -34.11 68.68 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.02 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.495 HD23 ' SD ' ' A' ' 65' ' ' MET . 95.8 mt -81.85 -20.4 39.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.253 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 32.0 mmtp -64.96 -28.13 69.31 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.076 0.465 . . . . 0.0 109.814 172.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.49 23.9 33.87 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.293 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.495 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -122.17 147.56 46.01 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.23 -176.37 4.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.832 0.348 . . . . 0.0 110.808 -178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 58.5 tttm -52.16 -44.14 64.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.195 -176.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.23 89.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.803 -174.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.7 OUTLIER -61.84 -50.02 73.96 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.702 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.507 ' O ' HG13 ' A' ' 74' ' ' ILE . 58.5 m80 -50.56 -46.12 57.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.186 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.476 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 43.1 mt-10 -64.67 -51.27 63.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.74 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.7 t -57.16 -50.11 73.85 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.301 0.376 . . . . 0.0 111.436 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.1 mt -52.84 -61.07 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.638 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.734 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 2.1 mt -77.36 -18.87 14.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.509 -170.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.0 m -69.14 -31.03 69.42 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -72.55 -32.45 66.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.306 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.466 HD22 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -66.39 -38.82 88.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.39 173.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.1 -69.72 0.46 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.083 -0.58 . . . . 0.0 111.816 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.453 ' O ' HG22 ' A' ' 74' ' ' ILE . 39.0 ttm180 -80.27 102.79 9.71 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.429 ' HB2' ' HD2' ' A' ' 81' ' ' PRO . 30.7 p-10 -71.22 155.42 93.07 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.178 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.734 ' HD3' ' HB ' ' A' ' 74' ' ' ILE . 60.0 Cg_endo -73.67 36.76 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.105 2.537 . . . . 0.0 113.91 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.4 t -79.75 -29.86 40.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -71.56 -38.98 70.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.809 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -88.4 108.68 19.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.833 -178.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -71.81 -63.08 1.2 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.228 -172.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -72.11 150.55 43.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.937 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.44 -37.21 80.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.559 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -60.22 -39.21 85.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.907 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -62.55 -38.66 90.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.304 0.573 . . . . 0.0 110.406 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 34.4 mtt180 -68.76 -38.46 80.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.951 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.24 -45.4 93.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.143 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.5 90.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.354 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.505 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.5 t80 -66.8 -36.77 83.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.823 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.1 mt -71.92 -46.09 61.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.389 . . . . 0.0 110.365 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 59' ' ' GLU . 3.7 mm? -65.14 -45.55 84.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.745 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -79.4 -5.4 54.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.369 -0.533 . . . . 0.0 110.472 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.546 ' HG2' HG12 ' A' ' 55' ' ' ILE . 32.8 tp60 -70.94 -31.9 68.63 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 41.6 mt -65.9 -26.76 39.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.635 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.3 t70 . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.954 179.111 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 67.9 p -108.69 143.6 37.58 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.359 -175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.39 138.69 52.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.544 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -141.28 134.74 29.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.584 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 21' ' ' ALA . 3.8 mm? -61.64 123.91 19.22 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.814 0.34 . . . . 0.0 110.646 176.209 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.542 HG13 ' HD2' ' A' ' 8' ' ' LYS . 13.5 pt -100.65 -23.01 4.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.014 173.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.542 ' HD2' HG13 ' A' ' 7' ' ' ILE . 2.0 mptp? -132.6 122.31 24.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.099 171.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.82 -137.44 8.68 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.218 -0.991 . . . . 0.0 112.888 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.77 ' HG3' ' H ' ' A' ' 11' ' ' THR . 49.6 pttt -168.01 -68.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.77 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.6 p -132.14 118.38 19.53 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -129.77 111.74 12.93 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 45.3 t-20 -95.92 120.03 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.225 -177.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.481 HG21 HD21 ' A' ' 35' ' ' LEU . 50.5 t -119.13 104.49 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 0.0 110.682 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.2 mtt 62.95 20.14 12.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.124 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.11 -30.19 5.73 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.379 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.29 116.34 30.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.8 m -96.58 108.81 21.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 -177.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.406 ' HB2' ' CD2' ' A' ' 6' ' ' LEU . 37.5 m-85 -90.08 144.6 25.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.537 ' HG3' HG22 ' A' ' 11' ' ' THR . 10.1 mpt_? -117.06 149.13 40.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.561 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HA ' ' HB2' ' A' ' 6' ' ' LEU . . . -63.31 109.82 1.7 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.588 176.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.65 -1.78 39.27 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.193 -178.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.7 t -117.47 125.54 74.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.76 0.314 . . . . 0.0 110.516 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 m -100.04 123.49 44.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.518 178.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -118.79 150.69 39.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.71 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -92.78 126.65 37.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.213 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.9 m -124.46 157.42 65.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.195 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.57 ' HD2' HD12 ' A' ' 31' ' ' LEU . 38.3 Cg_exo -62.21 156.91 47.72 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.936 2.424 . . . . 0.0 110.974 171.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -68.08 -15.85 63.77 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -172.772 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -71.65 -43.03 66.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.423 . . . . 0.0 110.026 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.57 HD12 ' HD2' ' A' ' 28' ' ' PRO . 38.0 mt -73.74 -33.69 64.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.902 175.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.591 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 84.4 t80 -53.65 -53.95 44.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.708 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 37' ' ' GLU . 4.2 mm-40 -65.94 -36.7 84.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.581 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -62.45 -45.84 91.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 110.276 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.481 HD21 HG21 ' A' ' 14' ' ' VAL . 95.5 mt -74.08 -25.9 60.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.037 0.446 . . . . 0.0 110.602 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.02 -26.31 68.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.093 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 41.8 mt-10 -77.82 -11.29 59.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.319 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 35.4 m-80 -102.38 113.81 65.7 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.93 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 19.1 Cg_exo -66.85 -7.39 18.3 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 123.184 2.589 . . . . 0.0 114.546 -173.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -101.62 17.0 23.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.416 -0.513 . . . . 0.0 111.917 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -119.33 131.68 55.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.457 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' HG21 ' A' ' 7' ' ' ILE . 14.0 tt -97.19 117.39 41.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.685 0.755 . . . . 0.0 108.998 166.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.47 ' HA ' ' O ' ' A' ' 3' ' ' THR . 4.9 mp -107.07 115.59 30.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.828 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.3 m . . . . . 0 C--N 1.313 -0.986 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.368 -176.208 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.469 ' O ' HG22 ' A' ' 55' ' ' ILE . 96.1 Cg_endo . . . . . 0 N--CA 1.458 -0.615 0 CA-C-O 120.495 0.123 . . . . 0.0 112.387 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.702 HG12 HD22 ' A' ' 77' ' ' LEU . 7.0 tp 52.45 24.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 124.142 0.977 . . . . 0.0 111.766 178.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.536 ' OD1' HG12 ' A' ' 98' ' ' ILE . 7.9 t30 -153.1 83.51 1.2 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.128 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.24 152.45 50.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.113 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.736 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 24.3 m -57.23 138.27 54.9 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.375 0.422 . . . . 0.0 110.247 172.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 1.3 pt-20 -58.78 -30.43 67.55 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.712 ' H ' HG22 ' A' ' 58' ' ' THR . 15.1 m -69.2 -26.95 65.08 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.242 175.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.736 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 8.5 mm-40 -79.19 -44.49 21.78 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-O 121.061 0.458 . . . . 0.0 110.19 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.405 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 57.9 mt -70.77 -20.63 62.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.455 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -65.12 -36.02 82.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.887 -177.195 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.08 42.16 1.96 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.719 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.402 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.6 mtt -117.53 166.37 12.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.032 0.444 . . . . 0.0 110.996 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.568 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 36.3 m-80 -83.51 162.36 20.93 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.293 174.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -67.21 -38.49 85.39 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.421 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.38 73.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.568 ' HG3' ' HB2' ' A' ' 66' ' ' ASN . 41.7 mt-10 -63.99 -49.89 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.466 ' O ' HG13 ' A' ' 74' ' ' ILE . 55.9 m80 -54.51 -44.46 72.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.022 173.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.3 mt-10 -57.81 -44.39 86.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.736 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.6 m -64.94 -45.56 85.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.945 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.0 mt -56.94 -59.71 2.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.347 0.594 . . . . 0.0 111.466 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 70' ' ' HIS . 5.2 mt -73.04 -21.49 19.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.036 -172.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.0 t -66.37 -36.46 82.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 175.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -69.51 -31.94 70.48 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.001 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.702 HD22 HG12 ' A' ' 55' ' ' ILE . 31.6 tp -63.1 -38.03 89.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.376 173.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.38 28.23 2.86 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.948 -177.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.515 ' HD2' ' OH ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -150.49 102.64 3.06 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 177.819 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -75.0 116.64 56.03 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.227 0.537 . . . . 0.0 110.269 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.52 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 96.0 Cg_endo -79.61 29.52 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 123.067 2.512 . . . . 0.0 112.738 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.96 -17.57 64.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.04 -27.25 30.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -82.43 109.05 16.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.733 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -71.73 -40.29 69.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.809 -174.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.538 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 19.2 m-80 -91.88 166.99 12.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.95 0.405 . . . . 0.0 110.148 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.527 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -85.77 -22.7 27.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.759 -178.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -63.0 -49.07 76.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.202 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.538 ' OE1' ' HB2' ' A' ' 86' ' ' ASN . 2.0 mp0 -58.57 -35.33 72.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.096 0.474 . . . . 0.0 110.615 177.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.0 mtt180 -66.14 -38.61 88.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.042 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 87' ' ' ALA . 77.0 mt -66.85 -45.06 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.008 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.23 99.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.427 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.515 ' OH ' ' HD2' ' A' ' 79' ' ' ARG . 64.3 t80 -65.95 -36.81 84.36 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.899 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' ARG . 77.5 mt -66.88 -36.4 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.147 177.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 98' ' ' ILE . 85.4 mt -62.57 -28.07 69.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.749 174.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 93' ' ' TYR . 37.7 ttmt -63.15 -30.41 71.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.548 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 22.0 mp0 -76.67 -31.76 57.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.478 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.536 HG12 ' OD1' ' A' ' 56' ' ' ASN . 45.0 mt -66.2 -34.66 71.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.633 0.73 . . . . 0.0 109.805 174.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t70 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.407 177.012 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.549 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 63.8 m-85 . . . . . 0 N--CA 1.454 -0.259 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.9 p -111.09 122.88 49.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.01 0.433 . . . . 0.0 110.954 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.21 127.64 54.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.351 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -121.22 118.33 29.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.834 0.35 . . . . 0.0 110.724 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -66.92 126.84 30.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.557 HD13 HG13 ' A' ' 42' ' ' ILE . 26.4 pt -116.99 -33.06 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.862 0.363 . . . . 0.0 111.959 -175.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 61.2 tttp -111.97 102.52 10.74 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -176.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.86 -119.0 1.47 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.411 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -176.5 -65.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -173.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 m -137.78 123.21 19.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.7 177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -127.64 146.82 50.42 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -175.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -119.44 117.26 27.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.606 0.241 . . . . 0.0 110.544 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -115.23 101.39 12.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.6 mtt 62.73 -86.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.31 178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.67 9.15 6.13 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.272 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.405 HD12 ' N ' ' A' ' 17' ' ' ILE . 4.4 mp -118.96 126.45 75.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.1 m -99.11 128.22 45.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.4 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -109.86 139.13 45.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.47 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.5 mtm-85 -116.49 142.43 46.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.17 117.3 3.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 111.623 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.87 0.34 55.12 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.765 -0.731 . . . . 0.0 113.045 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -109.55 116.44 52.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 111.005 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.6 m -83.2 106.75 15.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.728 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -109.84 139.42 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.525 -176.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -71.99 120.27 17.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.003 0.43 . . . . 0.0 110.533 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.8 m -112.98 158.32 38.16 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.339 -175.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 31' ' ' LEU . 34.0 Cg_exo -62.37 150.68 86.36 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.624 2.216 . . . . 0.0 111.293 172.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -59.12 -29.99 67.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.425 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.84 -44.6 85.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 0.0 110.693 176.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 34' ' ' TYR . 62.6 mt -76.07 -20.76 57.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.297 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.549 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 73.8 t80 -60.8 -47.86 84.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.895 0.379 . . . . 0.0 110.06 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -73.19 -35.36 66.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.058 0.456 . . . . 0.0 110.024 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 83.3 t80 -59.92 -29.83 68.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.746 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.4 mt -94.66 -16.26 23.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.003 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.32 -29.79 67.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.637 0.732 . . . . 0.0 109.821 177.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -90.6 7.46 39.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.253 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -115.18 106.64 50.92 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.611 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -76.58 40.67 0.8 Allowed 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.561 2.84 . . . . 0.0 115.337 -165.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.461 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 2.1 p90 -149.01 25.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 173.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.466 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 61.6 m-85 -127.06 138.61 53.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.226 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.557 HG13 HD13 ' A' ' 7' ' ' ILE . 46.8 mt -96.67 113.29 30.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.466 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 18.4 mt -100.32 107.79 19.67 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.763 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.443 -0.814 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.652 178.226 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo . . . . . 0 CA--C 1.531 0.346 0 N-CA-C 114.033 0.743 . . . . 0.0 114.033 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.662 HG12 HD13 ' A' ' 77' ' ' LEU . 10.2 tp -174.81 30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.899 0.856 . . . . 0.0 109.314 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -159.0 94.72 1.23 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.996 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -138.08 157.0 47.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.839 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.915 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.5 m -63.77 134.09 54.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 173.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 13.0 pt-20 -59.42 -33.45 71.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 p -69.22 -30.0 68.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.24 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.915 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 59.3 mm-40 -73.17 -37.25 66.61 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.635 176.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 97.6 mt -77.48 -15.34 59.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.581 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 27.4 mmtp -70.79 -37.24 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.753 0.311 . . . . 0.0 111.06 176.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.4 39.3 3.0 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.555 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 64.4 mtt -137.21 172.82 12.43 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.78 -157.51 0.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -68.62 -42.22 78.39 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.588 -175.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.62 62.78 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.8 mp0 -52.35 -55.88 18.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.971 0.415 . . . . 0.0 110.392 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.608 ' HE1' HG12 ' A' ' 91' ' ' ILE . 28.0 m-70 -58.96 -44.6 91.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.831 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 63.5 mt-10 -63.63 -41.46 98.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.772 -0.195 . . . . 0.0 111.108 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.1 p -65.34 -34.62 78.75 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.521 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 70' ' ' HIS . 96.6 mt -58.81 -57.59 10.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.962 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 70' ' ' HIS . 1.3 mt -72.55 -16.1 17.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.862 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 66.7 m -67.9 -36.51 80.33 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -66.44 -34.52 78.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.007 173.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.662 HD13 HG12 ' A' ' 55' ' ' ILE . 46.3 tp -63.59 -38.37 90.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.008 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 104.06 23.8 7.96 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.083 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.468 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 0.1 OUTLIER -131.66 126.23 34.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.727 0.298 . . . . 0.0 110.269 -178.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -73.89 136.51 76.77 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.888 178.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.481 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 5.0 Cg_exo -80.23 49.46 3.21 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.082 2.521 . . . . 0.0 111.329 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -49.75 -54.29 19.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.153 -170.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -106.27 24.73 12.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.338 0.589 . . . . 0.0 110.964 -174.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -107.61 120.27 41.76 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.466 ' HG2' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -115.56 -32.86 5.41 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.918 -175.02 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.58 169.59 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.548 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -72.98 -41.26 64.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.671 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.19 -44.8 88.23 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.632 0.582 . . . . 0.0 111.628 -177.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' A' ' 85' ' ' LYS . 33.3 mt-10 -58.09 -38.78 77.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 110.55 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.553 ' HD3' ' HB2' ' A' ' 70' ' ' HIS . 73.0 mtt85 -72.81 -32.04 65.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.711 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.608 HG12 ' HE1' ' A' ' 70' ' ' HIS . 75.8 mt -67.49 -47.15 81.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.15 -44.77 75.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.189 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.468 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 37.0 t80 -65.05 -40.51 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.92 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.489 ' O ' HG13 ' A' ' 98' ' ' ILE . 86.9 mt -67.52 -44.31 86.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.425 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.487 HD13 HD12 ' A' ' 98' ' ' ILE . 3.7 mm? -62.61 -41.37 98.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.292 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -65.32 -28.0 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 110.991 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -19.4 46.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.915 0.388 . . . . 0.0 110.39 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 94' ' ' ILE . 75.9 mt -74.27 -42.2 50.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 172.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.28 176.747 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 . . . . . 0 CA--C 1.516 -0.338 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -116.28 134.86 54.44 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -170.037 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.65 118.66 28.66 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 174.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 38.9 ttpt -119.11 126.4 51.54 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.835 0.35 . . . . 0.0 110.332 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.645 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -66.02 125.33 25.12 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.401 HG13 ' HG3' ' A' ' 8' ' ' LYS . 29.3 pt -111.9 -30.91 2.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.267 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 7' ' ' ILE . 64.2 mttp -127.89 111.53 13.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.781 0.324 . . . . 0.0 110.726 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.47 -13.29 3.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.658 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 61.5 mttp 71.39 -51.02 0.69 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.496 0.719 . . . . 0.0 111.922 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -150.35 129.45 12.69 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.741 0.305 . . . . 0.0 110.349 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -156.77 129.71 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 10.5 p30 -111.19 146.15 37.4 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.913 -177.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 HD21 ' A' ' 35' ' ' LEU . 44.6 t -127.93 99.25 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.274 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 61.9 mtm 57.74 49.55 12.1 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.855 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.49 -35.58 4.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.603 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.491 HD13 HD11 ' A' ' 31' ' ' LEU . 4.0 mp -80.24 108.76 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 29.2 m -91.44 126.77 36.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.017 -178.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 71.7 m-85 -108.03 146.04 33.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.81 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -133.87 154.88 50.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.688 0.28 . . . . 0.0 110.972 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.645 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -60.76 105.34 0.44 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.081 178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.74 11.17 47.89 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.688 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.67 108.21 24.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.887 0.375 . . . . 0.0 110.632 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.414 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 15.2 m -74.95 122.13 22.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.592 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -121.51 129.13 52.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.504 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.5 p -74.42 129.91 38.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.732 0.301 . . . . 0.0 110.351 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 29.5 m -120.73 153.4 56.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.468 -174.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.542 ' HD2' HD12 ' A' ' 31' ' ' LEU . 19.5 Cg_exo -67.12 164.99 28.03 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.714 2.276 . . . . 0.0 111.167 171.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.41 -29.99 70.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.858 0.361 . . . . 0.0 110.938 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -64.72 -50.16 68.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.713 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.542 HD12 ' HD2' ' A' ' 28' ' ' PRO . 45.2 mt -71.72 -29.41 64.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.503 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -55.44 -51.36 67.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.523 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 44.8 mt-10 -75.42 -31.25 60.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.98 0.419 . . . . 0.0 110.776 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -61.46 -33.36 73.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.303 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.536 HD22 ' CE1' ' A' ' 41' ' ' PHE . 93.2 mt -98.69 -12.61 20.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.982 177.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.559 ' HA ' HD11 ' A' ' 43' ' ' LEU . 5.8 t30 -61.22 -36.16 79.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.565 0.698 . . . . 0.0 109.882 173.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 37' ' ' GLU . 7.9 pt-20 -87.12 13.41 9.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.266 176.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 6.6 m-20 -116.58 122.96 31.07 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.792 0.329 . . . . 0.0 110.352 177.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 96.3 Cg_endo -88.64 22.42 0.86 Allowed 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.992 2.461 . . . . 0.0 114.101 -174.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -127.58 21.49 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.188 0.518 . . . . 0.0 111.669 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CE1' HD22 ' A' ' 35' ' ' LEU . 73.9 m-85 -128.49 145.49 51.09 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.492 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.9 tt -97.33 124.32 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 171.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 36' ' ' ASN . 12.5 mt -100.84 108.37 20.15 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.141 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 3' ' ' THR . 20.8 m . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.818 -174.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.442 ' O ' HG22 ' A' ' 55' ' ' ILE . 20.0 Cg_exo . . . . . 0 N--CA 1.465 -0.185 0 N-CA-C 111.754 -0.133 . . . . 0.0 111.754 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.786 HG12 HD22 ' A' ' 77' ' ' LEU . 10.8 tp 49.02 25.61 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-O 121.915 0.864 . . . . 0.0 111.458 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -141.62 96.46 2.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.819 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.453 ' HB2' HD11 ' A' ' 62' ' ' LEU . 83.8 m-85 -140.6 161.91 36.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.709 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.644 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 1.1 m -61.88 133.58 55.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 60' ' ' SER . 0.6 OUTLIER -66.5 -32.95 74.63 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.969 -0.693 . . . . 0.0 109.706 -179.115 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.492 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 10.8 m -69.73 -24.83 63.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.223 0.535 . . . . 0.0 109.819 174.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.644 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 59.4 tt0 -81.66 -35.52 29.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.849 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 57' ' ' TYR . 96.3 mt -83.06 -6.32 59.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.718 175.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD2' HD13 ' A' ' 91' ' ' ILE . 15.5 tptt -66.25 -27.1 67.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.626 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.21 -119.01 4.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 173.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.459 ' HB3' ' H ' ' A' ' 66' ' ' ASN . 24.2 mmt 59.74 -158.17 0.32 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.423 0.63 . . . . 0.0 111.927 174.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.762 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 42.9 t-20 -123.64 158.66 31.03 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.96 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -67.27 -36.36 81.4 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 71' ' ' GLU . . . -61.85 -32.77 73.14 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.131 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.762 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 12.5 mm-40 -62.66 -56.67 15.62 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.671 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.8 m80 -51.45 -40.61 59.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.963 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 45.1 mm-40 -51.84 -64.99 0.64 Allowed 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.302 0.376 . . . . 0.0 110.549 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.8 m -56.91 -44.47 82.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.216 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.2 mt -53.28 -57.22 5.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.648 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.671 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.2 mt -82.05 -20.96 10.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.753 -172.197 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.51 -33.38 74.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -73.38 -27.76 61.65 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.786 HD22 HG12 ' A' ' 55' ' ' ILE . 56.7 tp -65.89 -29.75 70.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.97 0.414 . . . . 0.0 110.173 172.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.84 9.38 26.56 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.466 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -133.47 97.82 4.05 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.461 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 14.5 m120 -68.42 131.8 91.59 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.698 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 80' ' ' ASN . 57.1 Cg_endo -88.92 65.39 2.75 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.924 2.416 . . . . 0.0 112.379 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.1 t -86.36 -31.7 21.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.471 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -90.05 -25.01 21.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.937 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -82.32 108.65 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -92.69 -61.92 1.5 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.52 -168.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -72.81 163.72 27.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.04 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -63.64 -45.73 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.52 -174.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.526 ' HA ' HD12 ' A' ' 91' ' ' ILE . 10.3 t70 -65.97 -32.27 73.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.077 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.37 -44.0 96.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.544 0.688 . . . . 0.0 110.074 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -68.57 -34.83 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.24 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 88' ' ' ASP . 86.3 mt -65.8 -41.51 90.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.12 176.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.34 83.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.71 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -63.33 -44.76 93.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.623 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.485 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.0 mt -61.33 -45.56 98.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.206 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -47.95 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.562 -177.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.0 mttp -67.13 -20.87 65.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -80.16 -40.49 27.2 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 94' ' ' ILE . 83.4 mt -63.74 -35.32 72.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.456 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.8 t70 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.199 -179.768 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 . . . . . 0 C--O 1.232 0.179 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.641 ' OG1' ' HB ' ' A' ' 44' ' ' THR . 73.9 p -131.59 155.48 47.44 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.686 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -126.84 137.8 53.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.224 177.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HB2' ' OG ' ' A' ' 24' ' ' SER . 5.8 ttpm? -120.73 116.97 26.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.104 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.602 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -67.99 124.28 22.95 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.582 HG13 ' N ' ' A' ' 8' ' ' LYS . 18.9 pt -117.61 -36.67 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.909 0.385 . . . . 0.0 111.695 -177.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.582 ' N ' HG13 ' A' ' 7' ' ' ILE . 44.9 tttm -92.06 30.56 1.4 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.747 -167.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.1 -126.7 0.85 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.62 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -160.13 -44.45 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.7 m -152.99 125.01 7.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.989 174.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -140.01 117.55 11.49 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.2 t-20 -91.22 115.87 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.3 t -106.38 97.29 5.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.726 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 62.8 mtt 59.39 22.65 11.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.931 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 121.6 -33.75 4.18 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.578 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.9 mm -78.32 108.79 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.3 m -91.06 101.22 13.97 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.702 0.286 . . . . 0.0 110.759 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 98.4 m-85 -86.06 144.37 27.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.587 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -124.97 143.26 50.98 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -51.71 118.27 3.26 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.67 4.03 59.33 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.768 -0.651 . . . . 0.0 113.224 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.5 t -117.75 112.1 37.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 117.024 0.412 . . . . 0.0 111.523 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 71.5 m -74.45 116.47 15.16 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.896 171.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.5 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 25.6 mt-30 -116.3 146.78 42.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.498 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.533 ' HA ' HG22 ' A' ' 3' ' ' THR . 13.0 p -67.51 131.81 46.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.127 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 35.6 m -134.7 144.83 52.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.922 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.557 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.7 Cg_exo -66.96 161.77 41.0 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.627 2.218 . . . . 0.0 110.883 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -59.02 -31.53 68.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.613 0.245 . . . . 0.0 111.469 -176.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.51 -48.49 79.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.862 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.557 HD12 ' HD2' ' A' ' 28' ' ' PRO . 68.9 mt -73.4 -29.01 62.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.667 0.27 . . . . 0.0 110.537 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -55.6 -48.95 74.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.962 174.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -71.56 -34.87 70.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.309 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 66.8 t80 -64.94 -40.84 95.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.595 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.498 HD22 ' CE1' ' A' ' 41' ' ' PHE . 73.6 mt -81.93 -20.13 39.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.741 0.305 . . . . 0.0 110.629 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -66.32 -26.05 67.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.679 0.752 . . . . 0.0 109.051 169.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB3' ' O ' ' A' ' 34' ' ' TYR . 13.7 tp10 -79.4 -15.42 57.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.929 176.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 40' ' ' TYR . 40.4 m-80 -115.14 113.18 43.85 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.532 -174.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 2.8 Cg_exo -75.32 41.34 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.016 2.477 . . . . 0.0 114.105 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 38' ' ' ASN . 9.1 m-85 -111.75 -6.26 14.34 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.926 0.393 . . . . 0.0 110.001 176.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.498 ' CE1' HD22 ' A' ' 35' ' ' LEU . 78.7 m-85 -124.41 141.79 51.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.783 -169.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.553 HG13 HD13 ' A' ' 7' ' ' ILE . 68.9 mt -110.57 111.25 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 164.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 6.3 mp -82.91 148.52 27.63 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 120.955 0.407 . . . . 0.0 111.193 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.641 ' HB ' ' OG1' ' A' ' 3' ' ' THR . 17.7 m . . . . . 0 C--N 1.318 -0.794 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.675 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.487 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 2.7 Cg_exo . . . . . 0 N--CA 1.461 -0.44 0 CA-C-O 120.763 0.235 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.459 HG12 HD13 ' A' ' 77' ' ' LEU . 10.4 tp -171.33 21.2 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 122.46 1.124 . . . . 0.0 108.998 174.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -153.29 100.17 2.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.901 -175.071 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.425 ' HB2' HD11 ' A' ' 62' ' ' LEU . 90.9 m-85 -142.66 177.83 8.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.316 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.642 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -76.76 133.37 39.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.928 177.694 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 63' ' ' LYS . 4.2 pt-20 -66.97 -33.01 74.65 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.46 -178.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 11.5 p -74.28 -22.71 59.17 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.642 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 53.9 tt0 -80.19 -40.58 26.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.452 176.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 81.0 mt -75.85 -9.98 59.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.746 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' A' ' 59' ' ' GLU . 7.6 tppt? -66.39 -19.84 65.91 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.13 -113.23 2.11 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.52 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.7 mtt 62.13 -175.4 0.14 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.53 0.681 . . . . 0.0 111.562 -177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.682 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 46.4 t30 -95.49 151.41 19.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.279 174.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 51.8 mtmt -54.1 -48.24 70.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.805 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.4 -30.39 64.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.088 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.682 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 7.0 mm-40 -63.67 -52.02 62.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 73' ' ' ILE . 77.7 m-70 -55.79 -44.21 77.57 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.49 -43.45 97.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.611 -177.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -64.19 -40.61 96.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.757 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.4 mt -51.99 -62.15 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.13 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.4 OUTLIER -76.45 -16.93 15.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.935 -174.035 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.0 t -66.34 -35.2 79.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -32.02 60.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.353 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.459 HD13 HG12 ' A' ' 55' ' ' ILE . 47.1 tp -63.51 -36.21 83.03 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.151 0.5 . . . . 0.0 110.404 174.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.9 5.3 33.41 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.112 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.13 119.5 39.48 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -63.07 122.57 75.99 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.053 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.72 -3.33 11.76 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.189 2.592 . . . . 0.0 111.926 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.0 m -68.34 -12.2 60.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.965 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.97 -34.37 71.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.188 0.518 . . . . 0.0 110.559 175.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.628 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . 57.8 m-85 -100.23 122.75 43.53 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.95 -171.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -82.33 -40.19 21.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.304 -178.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.87 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 94.6 m-20 -96.38 162.16 13.61 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.047 0.451 . . . . 0.0 111.597 -176.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.453 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -70.62 -36.08 73.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.54 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -63.92 -36.86 85.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.428 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.87 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 21.1 mm-40 -59.45 -40.37 86.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.368 0.604 . . . . 0.0 109.75 176.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.9 mtt85 -63.81 -49.14 74.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.619 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 87' ' ' ALA . 61.8 mt -60.08 -42.85 91.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.171 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.19 77.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.379 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -78.05 -41.15 36.42 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.519 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.551 ' O ' HG13 ' A' ' 98' ' ' ILE . 70.1 mt -62.49 -44.67 99.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.55 ' HA ' HD12 ' A' ' 98' ' ' ILE . 14.9 mt -62.23 -29.23 70.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.625 176.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.471 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 3.9 ttmp? -61.84 -42.37 98.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.775 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -81.1 -20.12 42.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 94' ' ' ILE . 96.6 mt -71.75 -44.27 68.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.127 0.489 . . . . 0.0 110.09 176.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.372 179.283 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.472 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 70.3 m-85 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 120.728 0.299 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -131.69 135.47 46.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.026 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.17 122.51 47.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.183 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.531 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 88.6 tttt -109.01 107.23 17.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.421 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.633 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -65.84 122.3 17.01 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.545 HD13 HG13 ' A' ' 42' ' ' ILE . 43.2 pt -113.78 -24.14 3.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -178.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -102.59 105.16 15.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -176.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 116.58 -129.84 8.65 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.474 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 97.9 mttt -154.68 -46.18 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.9 p -136.21 153.82 51.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.645 172.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -162.41 116.45 1.79 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.757 0.313 . . . . 0.0 110.159 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.6 t-20 -90.76 112.31 24.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -178.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 HD21 ' A' ' 35' ' ' LEU . 54.9 t -104.2 108.69 25.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.793 177.144 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 65.41 -75.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.795 0.684 . . . . 0.0 111.364 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.85 6.19 1.81 Allowed Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.607 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.2 mp -115.84 119.39 61.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 22.2 m -92.83 105.7 17.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.972 0.415 . . . . 0.0 110.585 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -84.64 161.82 19.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.414 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 62.6 mtt180 -133.66 136.99 45.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.446 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.633 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.29 109.49 0.55 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.817 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.17 -7.55 30.85 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.516 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.6 t -111.21 127.2 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -179.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 12.1 p -102.95 104.21 14.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.42 177.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -102.02 149.83 23.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 0.0 110.819 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -73.52 132.74 43.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.814 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.8 m -126.9 155.35 75.69 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.328 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -64.26 151.93 83.39 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.692 2.261 . . . . 0.0 110.962 172.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' H ' ' HG3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -64.75 -20.78 66.54 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.882 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -68.5 -45.86 71.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.354 0.597 . . . . 0.0 110.228 174.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 77.7 mt -75.18 -26.22 58.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.499 -179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.472 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 84.9 t80 -57.32 -50.76 71.93 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.327 177.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 8.0 mm-40 -70.86 -33.43 70.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.131 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -62.31 -46.14 90.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 110.656 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.516 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.9 mt -79.24 -19.46 50.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.058 0.456 . . . . 0.0 110.344 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 33' ' ' GLU . 32.7 t30 -62.97 -31.87 73.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.798 174.162 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.48 -1.12 55.22 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.877 176.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -123.48 117.72 27.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 111.682 -174.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.57 39.47 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 123.293 2.662 . . . . 0.0 113.851 -175.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.446 ' HB2' ' CD1' ' A' ' 41' ' ' PHE . 72.4 m-85 -98.38 -18.44 18.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.066 0.46 . . . . 0.0 110.208 176.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.516 ' CE1' HD22 ' A' ' 35' ' ' LEU . 68.3 m-85 -127.35 147.24 50.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.778 -169.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.545 HG13 HD13 ' A' ' 7' ' ' ILE . 60.0 mt -97.71 103.72 15.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 162.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.44 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.3 mp -87.06 131.24 34.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.608 -174.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.2 m . . . . . 0 C--N 1.318 -0.766 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.613 -177.792 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo . . . . . 0 N--CA 1.461 -0.404 0 N-CA-C 111.154 -0.364 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.683 HG21 HD13 ' A' ' 77' ' ' LEU . 11.2 tp -174.89 31.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 122.418 1.104 . . . . 0.0 108.397 -178.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -149.57 96.57 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.91 -173.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -142.72 165.67 26.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.537 -176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.403 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 21.6 m -64.9 129.81 41.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.353 175.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.4 pm0 -61.77 -38.59 88.59 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 179.103 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.8 m -62.26 -30.97 71.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.403 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 36.5 tt0 -78.44 -35.0 47.46 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.348 0.594 . . . . 0.0 109.83 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.7 mt -77.64 -14.8 59.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.97 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 70.8 mmtt -66.06 -27.73 68.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 65' ' ' MET . . . -97.72 -148.52 23.96 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 169.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.473 ' HG3' ' OE1' ' A' ' 69' ' ' GLU . 43.6 ttm 68.75 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.106 0.479 . . . . 0.0 111.128 175.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -73.5 163.28 28.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.536 . . . . 0.0 111.153 -174.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -56.83 -41.41 77.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.156 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.36 90.87 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.221 0.326 . . . . 0.0 111.38 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.473 ' OE1' ' HG3' ' A' ' 65' ' ' MET . 47.7 mt-10 -60.1 -56.31 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.429 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.635 ' O ' HG13 ' A' ' 74' ' ' ILE . 80.1 m80 -51.11 -42.22 60.52 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.212 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 38.7 mt-10 -68.59 -41.52 79.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.748 -177.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 27.2 t -63.34 -41.64 98.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 69' ' ' GLU . 76.0 mt -52.95 -58.86 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.403 176.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.635 HG13 ' O ' ' A' ' 70' ' ' HIS . 7.2 mt -72.28 -24.25 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.528 -173.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.53 ' HA ' ' O ' ' A' ' 79' ' ' ARG . 49.9 m -74.94 -33.12 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.987 0.423 . . . . 0.0 110.008 175.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.1 -31.05 71.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.228 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.683 HD13 HG21 ' A' ' 55' ' ' ILE . 35.4 tp -61.62 -29.44 70.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.002 174.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 118.72 -7.07 13.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.934 -0.651 . . . . 0.0 111.507 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 mmt180 -90.49 -172.78 3.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.699 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 63.0 t30 -150.8 109.29 3.09 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.68 178.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.54 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 5.2 Cg_exo -77.79 54.0 4.63 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 123.218 2.612 . . . . 0.0 112.896 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.0 p -83.61 -37.32 23.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.22 0.533 . . . . 0.0 110.568 177.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -93.94 7.32 45.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.447 0.641 . . . . 0.0 110.48 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -105.5 108.53 20.1 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -97.42 -45.05 6.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -171.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.541 ' HB2' ' HG3' ' A' ' 89' ' ' GLU . 39.2 m-80 -80.53 168.01 19.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.234 0.54 . . . . 0.0 111.541 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 90' ' ' ARG . . . -81.05 -36.92 29.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.507 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.539 ' HA ' HD12 ' A' ' 91' ' ' ILE . 18.5 t70 -70.94 -32.77 69.75 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.863 -178.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.541 ' HG3' ' HB2' ' A' ' 86' ' ' ASN . 50.8 mt-10 -59.5 -46.33 89.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 110.748 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 18.2 ptp180 -71.3 -27.55 63.49 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.528 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 88' ' ' ASP . 96.6 mt -65.43 -45.95 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.89 -42.81 80.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.769 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.418 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 42.3 t80 -68.22 -39.15 82.43 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.793 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 55' ' ' ILE . 70.5 mt -66.04 -37.97 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.899 0.381 . . . . 0.0 110.283 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 98' ' ' ILE . 13.3 mt -65.29 -37.5 87.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.402 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.9 tmtm? -59.06 -31.15 68.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.939 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.616 ' HG3' ' CG1' ' A' ' 55' ' ' ILE . 7.5 mm-40 -74.27 -30.94 62.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.487 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.507 HD12 HD23 ' A' ' 95' ' ' LEU . 56.0 mt -67.65 -28.16 40.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.373 177.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.96 0.409 . . . . 0.0 110.538 176.845 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 90.0 m-85 . . . . . 0 CA--C 1.52 -0.19 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -106.79 131.7 53.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.789 -177.744 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.47 137.28 53.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.172 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -139.59 137.91 35.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.757 0.313 . . . . 0.0 111.08 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -65.11 118.58 9.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.653 174.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.591 HG21 ' HB ' ' A' ' 42' ' ' ILE . 36.3 pt -100.26 -6.34 9.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.502 0.667 . . . . 0.0 109.796 175.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.6 tttp -140.19 130.79 25.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.483 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 109.12 -132.82 11.29 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.315 -0.945 . . . . 0.0 112.42 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -164.32 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.618 0.247 . . . . 0.0 110.364 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.514 HG22 ' HG2' ' A' ' 20' ' ' ARG . 12.4 p -145.16 134.99 23.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.238 179.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -147.18 128.07 14.44 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -97.5 107.86 20.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.793 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 35' ' ' LEU . 61.6 t -96.55 95.16 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.1 mtt 65.7 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.099 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -133.56 -1.87 3.73 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.938 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -102.06 113.81 39.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.5 m -87.99 116.55 26.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.733 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -98.59 151.09 21.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.735 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HG2' HG22 ' A' ' 11' ' ' THR . 15.5 mtp180 -132.32 137.84 47.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 109.9 1.02 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.028 0.442 . . . . 0.0 111.037 177.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.2 -3.32 28.32 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.308 -178.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -118.81 113.84 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.831 0.348 . . . . 0.0 111.026 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 3' ' ' THR . 33.6 m -85.09 126.05 33.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.262 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -129.17 151.48 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.37 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 1.2 p -80.92 138.59 36.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.855 0.359 . . . . 0.0 111.806 -176.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.9 153.4 81.7 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.959 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 7.6 Cg_exo -74.29 171.39 18.14 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 123.05 2.5 . . . . 0.0 112.264 175.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -51.9 -46.76 64.71 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.968 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.19 -45.34 94.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.411 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.8 mt -73.12 -28.93 62.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -58.44 -47.01 85.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -68.11 -41.29 81.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.575 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.98 -45.56 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.845 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 14' ' ' VAL . 87.2 mt -76.83 -23.44 52.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.84 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.69 -29.59 70.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.362 0.601 . . . . 0.0 109.705 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -78.07 -6.69 55.41 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 38.1 m-80 -118.87 101.5 50.23 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.61 -177.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 14.2 Cg_exo -69.42 11.66 0.35 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.523 2.816 . . . . 0.0 114.735 -171.092 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.552 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 17.7 p90 -105.18 10.57 33.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.258 0.552 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.443 ' CE2' HD22 ' A' ' 35' ' ' LEU . 45.1 m-85 -117.07 136.29 53.09 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.885 172.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.591 ' HB ' HG21 ' A' ' 7' ' ' ILE . 9.9 tt -97.25 133.5 38.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 167.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mp -120.79 141.56 50.4 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.162 0.506 . . . . 0.0 110.554 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.314 -0.944 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.586 179.807 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.45 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 74.4 Cg_endo . . . . . 0 N--CA 1.453 -0.868 0 N-CA-C 113.633 0.59 . . . . 0.0 113.633 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.531 HG12 HD13 ' A' ' 77' ' ' LEU . 9.3 tp 179.66 26.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.968 0.89 . . . . 0.0 109.666 174.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.466 ' HB2' HG12 ' A' ' 98' ' ' ILE . 6.5 p30 -161.88 105.3 1.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.793 -175.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.522 ' HB2' ' HG ' ' A' ' 62' ' ' LEU . 68.5 m-85 -142.89 161.65 37.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.039 -177.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 60' ' ' SER . 13.9 m -60.43 142.97 54.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.612 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 2.5 pp20? -60.01 -36.95 78.32 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.488 ' H ' HG22 ' A' ' 58' ' ' THR . 6.5 m -67.53 -29.19 68.53 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.187 176.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 33.5 tt0 -77.24 -34.51 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.88 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.522 ' HG ' ' HB2' ' A' ' 57' ' ' TYR . 87.5 mt -77.18 -21.24 54.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.11 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 29.4 mmtp -62.12 -40.24 95.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.906 172.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.82 47.68 2.5 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.155 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.482 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.9 mtt -141.03 136.52 32.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.464 ' ND2' ' HG2' ' A' ' 69' ' ' GLU . 11.2 p30 -71.17 173.2 7.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.015 0.436 . . . . 0.0 110.728 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.37 -41.21 94.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.009 -175.255 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.87 79.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.599 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.548 ' O ' HG13 ' A' ' 73' ' ' ILE . 58.7 mm-40 -59.6 -52.85 63.76 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.522 ' O ' HG13 ' A' ' 74' ' ' ILE . 53.0 m80 -52.46 -41.7 63.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.604 178.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 54.3 mt-10 -66.38 -45.64 79.38 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.709 -177.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.0 m -59.13 -47.0 86.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.666 0.269 . . . . 0.0 110.565 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.3 mt -50.99 -62.32 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.75 -178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.7 mt -74.59 -24.69 18.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.21 -172.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.0 t -68.04 -29.75 68.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -78.92 -25.17 43.69 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.911 0.386 . . . . 0.0 110.257 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.531 HD13 HG12 ' A' ' 55' ' ' ILE . 37.8 tp -67.59 -37.84 83.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.941 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.59 -1.49 10.26 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.688 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -107.1 133.71 51.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.848 0.356 . . . . 0.0 110.93 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.561 ' OD1' ' HB3' ' A' ' 82' ' ' SER . 23.9 t-20 -66.19 117.46 43.3 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.462 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.78 -5.6 17.49 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.632 2.221 . . . . 0.0 112.913 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.561 ' HB3' ' OD1' ' A' ' 80' ' ' ASN . 42.1 t -80.31 -9.01 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 177.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -69.57 -21.67 63.6 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -112.67 108.62 17.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.288 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -83.12 -41.72 18.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.259 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -89.36 150.48 22.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.068 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -37.96 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.355 176.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.32 -52.0 60.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.575 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -61.23 -43.57 98.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.025 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.415 ' O ' HG13 ' A' ' 94' ' ' ILE . 94.6 mtt180 -64.3 -41.89 96.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.319 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -66.77 -45.71 87.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.137 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 -38.65 80.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.818 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -70.91 -39.18 72.89 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.921 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.4 mt -66.07 -32.5 58.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.228 0.537 . . . . 0.0 109.94 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 HD12 ' A' ' 98' ' ' ILE . 4.0 mm? -73.86 -21.25 60.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.968 174.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -68.85 -33.05 73.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.717 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.75 -36.35 80.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 109.988 175.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.522 HD12 HD13 ' A' ' 95' ' ' LEU . 43.2 mt -67.61 -32.54 57.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.149 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.0 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.614 174.363 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.545 0.212 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.6 p -121.29 132.22 54.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.139 0.495 . . . . 0.0 110.943 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.6 128.87 55.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.356 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.461 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 6.0 ttpm? -114.13 121.63 44.36 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.626 0.25 . . . . 0.0 110.502 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.628 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 55.2 tp -62.84 124.95 22.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.99 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.0 pt -120.43 5.42 6.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.761 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -132.89 104.76 6.74 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.365 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.86 -121.27 5.64 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.629 ' HD2' ' HB3' ' A' ' 21' ' ' ALA . 41.9 tptt -169.38 -45.66 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 p -135.56 113.45 11.09 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.561 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -123.12 112.8 18.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.273 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.503 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 28.2 t-20 -92.63 107.79 19.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.941 0.401 . . . . 0.0 110.528 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.32 110.3 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.733 177.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 65.17 -80.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.808 0.693 . . . . 0.0 111.091 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -137.31 -1.93 2.43 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.237 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -104.64 115.98 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -178.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.3 m -89.38 106.25 18.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.927 0.394 . . . . 0.0 110.396 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -85.38 146.6 26.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.211 178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 75.7 mtt180 -121.25 132.46 54.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.193 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.629 ' HB3' ' HD2' ' A' ' 10' ' ' LYS . . . -59.51 112.93 1.96 Allowed 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.024 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.51 -12.03 25.76 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.058 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.7 t -116.63 119.55 62.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.649 0.261 . . . . 0.0 111.129 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.423 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 9.7 m -82.29 123.24 28.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -119.1 143.94 46.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.75 0.31 . . . . 0.0 110.642 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -70.74 131.24 43.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.421 -175.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.2 m -131.19 151.4 78.81 Favored Pre-proline 0 C--O 1.235 0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.537 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.547 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.9 Cg_exo -68.43 166.16 26.54 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.81 2.34 . . . . 0.0 111.671 175.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -62.14 -33.9 75.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.286 -175.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.96 -46.25 90.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.775 0.321 . . . . 0.0 110.63 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.547 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.3 mt -74.54 -23.22 58.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.697 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -62.63 -46.48 88.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 176.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 24.5 tp10 -76.22 -34.61 59.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.216 0.531 . . . . 0.0 110.198 177.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.457 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 49.5 t80 -58.55 -48.55 80.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.269 177.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD22 ' CE2' ' A' ' 41' ' ' PHE . 79.6 mt -79.55 -15.19 58.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.684 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.466 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 45.1 t30 -62.01 -40.56 96.1 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 173.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.5 5.32 31.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.915 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 35' ' ' LEU . 32.0 m-80 -123.9 97.51 41.05 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.824 0.345 . . . . 0.0 110.427 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -70.77 63.93 2.39 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 123.4 2.733 . . . . 0.0 113.359 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.435 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 81.1 m-85 -120.43 -14.02 8.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.011 173.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.568 ' CE2' HD22 ' A' ' 35' ' ' LEU . 57.3 m-85 -129.21 151.42 49.9 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.211 -167.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.7 tt -97.24 118.45 43.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 166.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.6 mt -94.35 129.28 41.11 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.227 -175.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 -176.247 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.457 -0.67 0 N-CA-C 113.673 0.605 . . . . 0.0 113.673 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -174.94 35.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 122.293 1.044 . . . . 0.0 109.496 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -156.72 82.41 0.95 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.989 -172.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.413 ' N ' HD11 ' A' ' 98' ' ' ILE . 70.1 m-85 -142.37 150.06 40.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.687 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.937 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 14.0 m -60.82 138.75 58.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.562 0.22 . . . . 0.0 111.155 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.63 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.1 -37.43 77.13 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.171 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.55 ' H ' HG22 ' A' ' 58' ' ' THR . 18.6 m -70.01 -20.51 63.27 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.695 177.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.937 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 47.8 mm-40 -80.93 -45.62 16.42 Favored 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 120.227 -0.589 . . . . 0.0 109.713 173.008 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.456 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 87.4 mt -68.03 -18.58 64.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.842 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 1.6 mptm? -67.01 -33.46 75.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.943 0.402 . . . . 0.0 110.494 174.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.74 -22.01 27.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.049 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.9 mtp -73.32 136.69 44.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 110.423 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -70.65 167.36 18.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.261 -174.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 1.5 tmmt? -60.51 -41.24 93.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.9 68.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.862 176.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' O ' HG13 ' A' ' 73' ' ' ILE . 13.7 mm-40 -67.45 -50.01 61.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.204 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.456 ' HE1' ' O ' ' A' ' 62' ' ' LEU . 76.4 m80 -52.14 -44.5 64.59 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.698 175.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 86.4 mt-10 -60.42 -53.78 53.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.679 176.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.5 m -51.96 -44.39 63.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.972 0.415 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.1 mt -59.72 -62.52 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.711 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.588 HD12 ' HB3' ' A' ' 81' ' ' PRO . 4.4 mt -78.13 -10.4 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.627 -170.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m -80.82 -33.22 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.129 -0.357 . . . . 0.0 110.052 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -70.35 -27.11 64.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.108 0.48 . . . . 0.0 109.794 174.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.3 -23.35 65.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.968 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.41 18.61 52.22 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.579 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -40.08 6.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.659 0.229 . . . . 0.0 110.655 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 67.91 105.64 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.786 0.679 . . . . 0.0 110.832 -176.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.588 ' HB3' HD12 ' A' ' 74' ' ' ILE . 90.2 Cg_endo -84.2 34.17 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.805 2.337 . . . . 0.0 112.864 -177.312 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 p -76.41 -26.37 55.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.483 177.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.28 -31.99 62.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.435 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -82.56 108.86 16.27 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.57 -31.79 28.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.273 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.881 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 86.1 m-20 -92.27 141.69 28.29 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.62 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.276 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -60.4 -37.76 81.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.468 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.881 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 31.2 mm-40 -65.81 -35.05 79.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.465 0.65 . . . . 0.0 109.62 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -70.53 -35.4 73.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 176.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 87' ' ' ALA . 37.5 mm -61.93 -54.07 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -58.31 -40.27 81.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.869 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -67.7 -46.15 73.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.525 0.202 . . . . 0.0 111.067 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.76 -41.49 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.14 0.495 . . . . 0.0 109.885 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.523 HD13 HD12 ' A' ' 98' ' ' ILE . 4.2 mm? -67.99 -29.65 68.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.111 178.179 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 38.5 tptt -72.52 -18.43 61.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.058 0.456 . . . . 0.0 110.778 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.15 -30.28 27.97 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 95' ' ' LEU . 39.4 mt -71.19 -35.61 58.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.0 t70 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.532 176.18 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.8 p -114.9 148.36 38.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.966 0.412 . . . . 0.0 110.618 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -130.95 134.54 46.83 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.133 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.786 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 1.6 ttmp? -120.16 118.75 31.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.135 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.686 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 40.0 tp -71.3 128.2 35.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.821 HG13 ' HG3' ' A' ' 8' ' ' LYS . 41.5 pt -113.74 -17.16 8.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.866 0.365 . . . . 0.0 110.986 -177.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.821 ' HG3' HG13 ' A' ' 7' ' ' ILE . 96.5 mttt -133.1 138.69 46.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -177.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.66 -13.93 24.87 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.854 178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.6 tttm 73.92 -52.89 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.532 0.733 . . . . 0.0 110.924 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.5 m -151.94 119.33 5.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.93 177.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.458 ' CE2' HG22 ' A' ' 14' ' ' VAL . 30.2 t80 -141.19 126.33 18.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.731 -178.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -92.14 125.49 36.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.912 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.458 HG22 ' CE2' ' A' ' 12' ' ' TYR . 47.9 t -104.81 104.94 17.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 175.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.5 mtt 65.41 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.112 -175.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.83 0.04 2.07 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.517 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.7 mp -101.3 123.48 54.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -178.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 m -83.31 116.61 22.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.943 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 96.9 m-85 -106.23 140.61 38.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.745 0.307 . . . . 0.0 110.189 175.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -127.66 148.28 50.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.686 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.21 112.29 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.624 0.249 . . . . 0.0 111.167 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.08 5.28 57.36 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.387 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.6 112.37 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.997 0.427 . . . . 0.0 110.15 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.786 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 16.0 m -92.45 123.98 36.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.63 150.41 51.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.819 0.343 . . . . 0.0 111.001 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 m -79.78 138.81 37.36 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.127 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.52 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 34.7 m -134.93 158.23 75.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.723 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.6 Cg_exo -68.95 171.32 13.76 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.769 2.313 . . . . 0.0 111.577 173.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.502 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 11.4 tmtt? -66.19 -31.13 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -177.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.84 -53.81 52.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.451 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.52 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 65.3 mt -70.23 -34.69 73.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.214 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -56.18 -46.77 79.26 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -71.53 -43.15 66.98 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.895 0.379 . . . . 0.0 110.574 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -58.0 -38.52 76.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.662 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.531 HD22 ' CE1' ' A' ' 41' ' ' PHE . 78.6 mt -88.75 -9.01 53.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.047 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -76.44 -23.94 53.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 172.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -84.41 -12.95 53.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.526 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -112.41 103.27 55.34 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.659 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.55 11.44 0.48 Allowed 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.411 2.74 . . . . 0.0 114.195 -173.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -85.1 -3.72 58.9 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.582 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 79.1 m-85 -118.82 131.47 56.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.11 -176.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.564 HG13 HD13 ' A' ' 7' ' ' ILE . 27.9 mt -97.45 104.12 15.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 166.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 4.7 mp -88.74 162.44 16.24 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.357 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.321 -0.658 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.001 -177.893 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.551 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 71.8 Cg_endo . . . . . 0 CA--C 1.53 0.279 0 CA-C-O 120.849 0.27 . . . . 0.0 112.465 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.669 HG12 HD13 ' A' ' 77' ' ' LEU . 9.6 tp -170.7 22.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.454 1.121 . . . . 0.0 109.042 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.472 ' HA ' HG12 ' A' ' 98' ' ' ILE . 39.5 t30 -159.11 98.86 1.47 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.679 -173.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.551 ' OH ' ' HA ' ' A' ' 54' ' ' PRO . 95.9 m-85 -140.11 -174.66 3.99 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.51 -176.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.729 ' HB ' ' HB3' ' A' ' 61' ' ' GLU . 3.0 m -79.59 129.47 34.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.583 ' HB3' HD21 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -63.29 -39.65 95.17 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.822 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.51 ' HA ' ' HE3' ' A' ' 63' ' ' LYS . 50.2 m -64.95 -29.3 70.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.978 0.418 . . . . 0.0 109.971 174.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.729 ' HB3' ' HB ' ' A' ' 58' ' ' THR . 39.7 tt0 -76.23 -38.75 55.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.96 -27.52 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.245 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 60' ' ' SER . 48.3 mtmt -76.42 -1.24 26.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.26 26.46 8.2 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 172.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.506 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 24.1 mmt -119.33 161.71 20.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.554 -0.323 . . . . 0.0 110.444 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 16.2 m-80 -91.62 -167.81 1.88 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.472 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -79.46 -35.22 40.69 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.229 -177.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.12 77.23 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.409 0.443 . . . . 0.0 112.017 -171.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HG3' ' HB3' ' A' ' 65' ' ' MET . 2.6 pm0 -63.03 -47.0 84.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.775 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.52 ' HE1' HG12 ' A' ' 91' ' ' ILE . 19.7 m-70 -55.31 -41.37 72.28 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.565 0.222 . . . . 0.0 111.079 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.485 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 42.6 mt-10 -65.73 -50.15 65.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.986 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 m -58.59 -38.11 77.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.481 HG23 ' O ' ' A' ' 54' ' ' PRO . 69.1 mt -54.61 -61.97 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.407 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.518 HD12 ' HB3' ' A' ' 81' ' ' PRO . 2.0 mt -79.3 -21.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.983 -170.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.5 p -71.19 -25.5 62.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.541 -0.464 . . . . 0.0 109.779 175.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -76.25 -33.35 59.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.107 172.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.669 HD13 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -62.47 -38.89 91.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.117 0.484 . . . . 0.0 110.708 174.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.32 -46.99 1.04 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.233 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.521 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 48.8 ttt85 -77.37 111.7 13.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.134 0.492 . . . . 0.0 109.768 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -62.32 130.66 93.33 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.085 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.518 ' HB3' HD12 ' A' ' 74' ' ' ILE . 91.9 Cg_endo -86.53 24.92 0.71 Allowed 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 123.254 2.636 . . . . 0.0 112.718 -177.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.2 m -73.65 -36.81 65.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.921 0.391 . . . . 0.0 110.344 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -73.59 -27.42 61.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.535 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.421 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 87.7 m-85 -82.52 108.88 16.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.293 177.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 37.3 ttmt -99.37 -54.61 2.91 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.05 -171.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -83.15 158.47 22.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.903 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.11 73.23 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.173 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -50.44 -49.23 55.57 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.637 0.586 . . . . 0.0 110.882 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.18 -49.39 74.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.981 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.7 mtt180 -64.2 -43.52 94.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.085 -176.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.52 HG12 ' HE1' ' A' ' 70' ' ' HIS . 91.1 mt -71.3 -43.88 73.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.178 -176.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -58.81 -40.21 83.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 111.174 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.521 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 41.9 t80 -68.1 -42.57 80.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.47 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.503 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.9 mt -60.92 -39.71 82.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.583 HD21 ' HB3' ' A' ' 59' ' ' GLU . 38.3 mt -55.55 -40.73 72.26 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.025 177.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 92' ' ' ALA . 66.0 mttm -60.33 -34.27 73.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.391 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -83.55 -18.99 36.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.014 0.435 . . . . 0.0 110.621 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.532 HD12 HD23 ' A' ' 95' ' ' LEU . 78.1 mt -70.07 -41.79 79.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.912 176.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.559 176.797 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 120.727 0.299 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 p -127.42 139.55 52.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.431 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.17 128.2 54.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -111.32 105.5 14.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.018 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 50.6 tp -65.72 116.89 7.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.562 HG21 HG13 ' A' ' 42' ' ' ILE . 42.5 pt -107.1 -29.87 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.811 0.339 . . . . 0.0 111.58 -175.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 50.4 mttm -106.5 128.91 54.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.322 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.24 -128.51 8.57 Favored Glycine 0 N--CA 1.441 -0.981 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.126 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -170.12 -46.94 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -175.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.26 113.49 6.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.685 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -123.1 104.21 9.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.338 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 23.8 t-20 -90.23 122.2 32.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.848 0.356 . . . . 0.0 111.034 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.8 t -119.99 111.78 34.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.763 174.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.1 mtt 64.52 -95.29 0.04 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.884 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.94 17.42 6.33 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.056 -0.593 . . . . 0.0 111.712 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 HD11 ' A' ' 31' ' ' LEU . 4.6 mp -123.42 110.87 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 30.5 m -90.53 107.34 19.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.631 177.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 91.9 m-85 -84.91 151.02 24.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 179.211 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 46.6 mtm180 -133.83 145.68 49.93 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.562 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -54.61 114.82 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.993 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.84 -7.16 67.54 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.626 177.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.6 t -100.82 125.43 54.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.873 0.368 . . . . 0.0 111.275 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 m -94.59 121.73 36.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.122 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -124.57 146.06 49.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.601 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.8 m -75.13 126.71 31.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.6 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.9 m -122.75 154.33 63.65 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-O 120.678 0.275 . . . . 0.0 111.45 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.565 ' HD2' HD12 ' A' ' 31' ' ' LEU . 21.2 Cg_exo -66.86 164.23 30.4 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.8 2.334 . . . . 0.0 111.015 172.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -64.19 -32.58 74.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.001 -175.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -54.57 -52.02 63.44 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.995 0.426 . . . . 0.0 110.489 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 28' ' ' PRO . 49.3 mt -67.92 -33.63 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.472 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 87.4 t80 -59.13 -44.13 92.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.879 0.371 . . . . 0.0 110.305 178.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -77.7 -40.17 42.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -59.76 -40.43 88.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.329 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -87.67 -13.48 42.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 8.1 t30 -63.83 -36.9 85.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.16 8.18 16.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.468 176.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 31.5 m-80 -127.99 91.93 43.46 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.118 0.485 . . . . 0.0 110.157 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -75.14 57.0 4.51 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.745 2.963 . . . . 0.0 114.643 -169.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 3.3 p90 -133.58 22.36 3.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.649 0.738 . . . . 0.0 110.121 170.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.79 148.93 50.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.766 175.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 HG21 ' A' ' 7' ' ' ILE . 50.3 mt -97.03 110.09 24.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 163.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 68.6 mt -91.84 133.1 35.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.367 -175.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.419 -177.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.423 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 11.9 Cg_exo . . . . . 0 CA--C 1.528 0.219 0 N-CA-C 113.033 0.359 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.83 HG12 HD13 ' A' ' 77' ' ' LEU . 9.5 tp -179.47 26.67 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 122.047 0.927 . . . . 0.0 109.716 175.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.538 ' HB3' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -163.78 98.09 0.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.654 -174.025 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -142.3 160.13 40.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.502 -177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.498 ' HB ' ' H ' ' A' ' 61' ' ' GLU . 1.7 m -57.16 137.3 56.04 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.467 0.479 . . . . 0.0 110.175 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HB3' HD11 ' A' ' 95' ' ' LEU . 0.6 OUTLIER -62.81 -31.17 72.11 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.369 -0.532 . . . . 0.0 109.865 176.8 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.2 t -64.87 -41.38 95.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.599 172.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -68.35 -42.17 79.65 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.35 179.525 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.456 HD23 ' SD ' ' A' ' 65' ' ' MET . 99.9 mt -66.39 -32.62 74.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.41 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HG3' HD13 ' A' ' 91' ' ' ILE . 43.1 mtmt -76.71 -16.96 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.055 0.455 . . . . 0.0 110.538 175.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.05 23.27 36.63 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.636 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.1 mtt -117.67 160.71 20.85 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.271 0.558 . . . . 0.0 111.042 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.572 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 38.6 t30 -74.02 152.54 39.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.055 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 49.4 mtmt -52.45 -47.07 66.64 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.337 177.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.3 64.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.776 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 26.8 mm-40 -66.21 -44.45 83.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.579 ' O ' HG13 ' A' ' 74' ' ' ILE . 76.3 m-70 -57.64 -42.84 84.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.09 0.472 . . . . 0.0 110.247 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 4.3 mm-40 -63.5 -46.25 86.96 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.65 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.8 p -72.57 -36.18 68.14 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.643 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 69' ' ' GLU . 81.7 mt -56.6 -55.86 17.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.18 0.514 . . . . 0.0 110.716 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.4 mt -77.14 -18.58 14.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.019 0.438 . . . . 0.0 110.537 -175.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.1 t -64.65 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.11 -34.97 79.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.297 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.83 HD13 HG12 ' A' ' 55' ' ' ILE . 58.2 tp -59.06 -34.89 72.48 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.183 0.515 . . . . 0.0 110.545 174.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.22 14.73 11.4 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.036 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HD3' ' OH ' ' A' ' 93' ' ' TYR . 48.9 ttt180 -145.78 92.76 2.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.147 0.498 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.578 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 51.0 t30 -58.67 132.48 85.99 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.676 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.578 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 85.2 Cg_exo -44.95 84.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.987 3.125 . . . . 0.0 113.575 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.3 t -78.83 108.63 12.41 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.925 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.5 t70 51.68 62.05 2.9 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.978 0.799 . . . . 0.0 111.731 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -116.97 108.09 15.36 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 171.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -99.6 -32.4 11.11 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.065 0.46 . . . . 0.0 110.246 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -72.1 124.33 24.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.98 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.43 88.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.888 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.56 -25.87 67.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.288 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -67.38 -42.68 82.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.685 0.279 . . . . 0.0 110.551 -177.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 mtt-85 -62.07 -43.59 98.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.372 0.606 . . . . 0.0 109.779 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.411 HD13 ' HG3' ' A' ' 63' ' ' LYS . 45.1 mt -67.63 -42.51 86.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.229 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.35 78.17 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.271 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.438 ' OH ' ' HD3' ' A' ' 79' ' ' ARG . 30.1 t80 -68.91 -38.84 79.83 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.206 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.445 ' O ' HG13 ' A' ' 98' ' ' ILE . 73.6 mt -65.82 -47.16 86.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.02 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 59' ' ' GLU . 95.1 mt -62.09 -38.36 88.58 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.082 0.468 . . . . 0.0 111.013 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -61.85 -36.5 81.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.426 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -22.51 60.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.538 HG12 ' HB3' ' A' ' 56' ' ' ASN . 53.6 mt -73.57 -40.31 54.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 109.686 175.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.5 t70 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.156 179.724 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.417 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 61.3 m-85 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.4 t -126.37 147.39 49.77 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.63 135.23 54.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.933 0.397 . . . . 0.0 110.918 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -119.4 118.35 30.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.462 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.66 130.42 43.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 42' ' ' ILE . 40.4 pt -120.14 -0.52 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.835 0.35 . . . . 0.0 111.408 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 88.7 tttt -135.71 121.54 19.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.79 -174.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 100.43 -125.05 8.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.45 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 38.6 ttmt -155.37 -52.08 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.5 m -144.29 126.48 15.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.907 0.384 . . . . 0.0 111.168 -178.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -142.5 131.04 22.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.033 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 65.1 t30 -93.92 120.54 34.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.113 0.482 . . . . 0.0 111.166 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 90.7 t -99.89 95.17 3.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.914 176.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.3 mtt 62.8 -81.02 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.826 -176.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.17 -2.13 5.59 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.96 177.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -103.57 105.62 18.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -178.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 4.1 m -86.2 117.69 25.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.878 0.371 . . . . 0.0 110.545 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 25' ' ' GLN . 96.1 m-85 -103.88 152.95 21.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 36.5 mtm180 -124.09 139.77 53.61 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.821 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.774 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -51.13 118.63 3.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.108 0.48 . . . . 0.0 111.24 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.89 -22.46 35.23 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.3 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -93.16 122.4 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 110.698 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -95.19 125.55 39.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.746 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 19' ' ' PHE . 25.9 mt-30 -130.87 140.72 50.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.061 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.0 p -67.7 133.25 48.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.741 -175.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -121.96 149.63 54.29 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.327 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.544 ' HD2' HD12 ' A' ' 31' ' ' LEU . 22.5 Cg_exo -65.74 163.12 31.72 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.766 2.311 . . . . 0.0 110.774 171.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -63.27 -29.04 70.44 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.433 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.75 -53.69 50.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.437 175.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.544 HD12 ' HD2' ' A' ' 28' ' ' PRO . 67.2 mt -67.98 -25.55 65.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.038 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 81.2 t80 -59.68 -47.26 86.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 176.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -73.21 -38.75 65.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.807 0.337 . . . . 0.0 110.628 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.414 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 86.9 t80 -58.29 -47.64 83.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.914 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.55 ' HB2' HD21 ' A' ' 43' ' ' LEU . 89.2 mt -80.63 -22.21 40.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.035 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 53.3 t30 -63.29 -28.79 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.512 0.673 . . . . 0.0 109.729 174.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -81.39 0.05 39.19 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.59 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -121.76 116.61 30.28 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.205 0.526 . . . . 0.0 111.258 -176.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.59 10.37 2.25 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 123.169 2.579 . . . . 0.0 114.605 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 5.4 p90 -107.02 12.09 29.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.438 0.637 . . . . 0.0 110.482 177.235 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -127.35 127.58 44.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.325 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 7' ' ' ILE . 50.4 mt -97.52 109.96 24.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.55 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.2 mp -94.83 149.78 20.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.822 -178.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.7 m . . . . . 0 C--N 1.317 -0.821 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 -177.828 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo . . . . . 0 N--CA 1.451 -1.023 0 N-CA-C 111.967 -0.051 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.666 HG12 HD22 ' A' ' 77' ' ' LEU . 10.7 tp 38.78 61.2 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.863 0.865 . . . . 0.0 112.951 173.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -174.43 87.52 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.586 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -142.86 161.94 36.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.736 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.643 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 2.0 m -74.19 143.74 45.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.627 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -34.69 78.77 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.357 0.599 . . . . 0.0 109.959 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.6 m -75.83 -25.95 56.74 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.582 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.643 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 56.2 tt0 -77.19 -44.81 28.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.405 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.478 HD23 ' SD ' ' A' ' 65' ' ' MET . 89.9 mt -65.2 -33.6 76.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.585 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -72.45 -12.75 61.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.843 176.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.56 28.48 13.26 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 176.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.478 ' SD ' HD23 ' A' ' 62' ' ' LEU . 58.2 mtt -119.67 -171.24 2.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 111.078 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.494 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 9.7 t-20 -114.7 162.92 16.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.668 176.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 18.9 ptmt -56.05 -40.24 73.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.297 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.72 -49.68 74.44 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -170.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.536 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 pm0 -59.39 -46.88 87.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.077 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.446 ' O ' HG13 ' A' ' 74' ' ' ILE . 72.2 m80 -50.38 -50.7 50.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.972 0.415 . . . . 0.0 110.922 177.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 4.0 mm-40 -61.88 -43.66 98.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.704 -176.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -63.03 -44.4 96.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.742 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.8 mt -52.63 -58.33 2.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.919 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.478 HD12 ' HB3' ' A' ' 81' ' ' PRO . 0.8 OUTLIER -75.48 -21.88 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.043 -172.75 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.9 m -70.63 -23.95 62.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.848 0.356 . . . . 0.0 110.699 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -82.96 -30.11 28.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.101 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.666 HD22 HG12 ' A' ' 55' ' ' ILE . 51.2 tp -67.75 -37.97 82.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.848 174.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 133.94 -60.82 0.65 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.016 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 62.1 ttt180 -65.92 108.1 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -63.74 142.36 98.04 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.649 -175.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 55.2 Cg_endo -67.13 -7.6 19.31 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 123.569 2.846 . . . . 0.0 112.51 -176.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.7 m -64.25 -17.58 63.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.77 179.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -76.2 -20.34 57.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.257 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -111.11 112.72 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.016 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.75 -36.04 32.51 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -173.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.4 ' HB3' ' OD1' ' A' ' 88' ' ' ASP . 66.8 t30 -107.01 164.22 12.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.74 0.305 . . . . 0.0 110.642 -176.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.436 ' HA ' ' HD2' ' A' ' 90' ' ' ARG . . . -64.89 -34.12 77.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.847 -177.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.4 ' OD1' ' HB3' ' A' ' 86' ' ' ASN . 22.8 p-10 -64.24 -47.4 79.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.207 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -60.25 -38.25 82.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.911 0.386 . . . . 0.0 110.843 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 87' ' ' ALA . 55.3 mtt85 -58.78 -52.22 66.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.431 175.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.77 -44.54 96.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.258 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.24 -41.32 75.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.432 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 27.2 t80 -72.58 -34.86 67.74 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.998 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.8 mt -67.77 -41.87 85.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 98' ' ' ILE . 4.4 mm? -65.71 -38.53 89.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.766 176.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -57.33 -37.71 72.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.929 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -7.77 59.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.948 -175.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 95' ' ' LEU . 27.9 mt -72.91 -44.82 57.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 173.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.571 -179.591 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.9 p -122.9 136.35 54.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.771 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.4 117.72 29.25 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.657 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.448 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 34.9 ttpt -106.63 121.22 43.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.062 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.825 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 26.0 tp -66.42 116.08 7.04 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.557 HG13 ' HG3' ' A' ' 8' ' ' LYS . 31.9 pt -106.15 -13.08 9.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 120.96 0.41 . . . . 0.0 111.586 -174.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HG3' HG13 ' A' ' 7' ' ' ILE . 95.2 mttt -130.36 109.88 11.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.183 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.6 -120.49 2.56 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.229 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -171.72 -66.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 m -135.05 113.05 11.06 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.45 ' CE2' HG22 ' A' ' 14' ' ' VAL . 26.1 t80 -133.08 130.55 39.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.95 0.405 . . . . 0.0 111.056 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -97.65 125.53 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.831 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 35' ' ' LEU . 44.4 t -112.58 115.89 51.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.421 ' SD ' HD21 ' A' ' 31' ' ' LEU . 61.4 mtt 67.88 -73.85 0.08 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.478 0.711 . . . . 0.0 111.076 -177.432 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 19.75 0.28 Allowed Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.469 HD13 HD11 ' A' ' 31' ' ' LEU . 3.9 mp -118.15 137.34 52.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.0 m -95.08 118.0 31.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 111.548 -176.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 77.5 m-85 -106.16 140.11 39.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.028 177.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.402 ' HB2' ' HB ' ' A' ' 23' ' ' VAL . 79.3 mtp180 -122.82 142.46 50.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.096 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.825 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -65.54 106.13 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.003 0.43 . . . . 0.0 110.725 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 109.6 -5.38 31.19 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.204 -178.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.402 ' HB ' ' HB2' ' A' ' 20' ' ' ARG . 61.0 t -113.61 122.11 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.838 0.351 . . . . 0.0 110.705 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 12.4 m -82.13 100.59 9.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.216 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -86.72 142.26 28.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.624 -176.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.5 m -81.1 125.43 30.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.65 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 33.0 m -130.49 155.82 80.53 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.253 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -74.27 162.22 38.96 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.53 2.153 . . . . 0.0 110.539 170.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 83.1 tttt -60.55 -23.81 64.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.61 0.243 . . . . 0.0 110.824 -178.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -56.6 -52.08 66.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.083 0.468 . . . . 0.0 109.893 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 59.2 mt -75.78 -29.06 58.63 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.768 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 89.8 t80 -57.47 -43.26 83.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.006 0.432 . . . . 0.0 110.513 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -80.09 -40.01 28.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.27 0.557 . . . . 0.0 110.305 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.19 -35.1 76.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.958 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 14' ' ' VAL . 90.3 mt -92.68 -15.72 26.39 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.259 -0.276 . . . . 0.0 110.901 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.43 -37.38 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.0 109.817 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.73 6.61 10.38 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.67 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -116.15 113.78 41.34 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.046 0.451 . . . . 0.0 110.424 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.92 23.74 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 123.206 2.604 . . . . 0.0 114.517 -171.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 6.8 p90 -122.25 16.69 10.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.498 0.666 . . . . 0.0 110.392 175.343 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.507 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.49 135.5 49.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.779 173.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.448 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.7 tt -98.81 128.37 50.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.97 118.17 32.67 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.166 -0.613 . . . . 0.0 111.371 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.967 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.5 ' O ' HG22 ' A' ' 55' ' ' ILE . 17.2 Cg_endo . . . . . 0 CA--C 1.529 0.25 0 N-CA-C 113.436 0.514 . . . . 0.0 113.436 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' O ' ' A' ' 54' ' ' PRO . 7.6 tp 52.29 26.84 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.389 1.075 . . . . 0.0 111.951 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.405 ' OD1' HG13 ' A' ' 98' ' ' ILE . 6.2 t30 -147.62 80.75 1.5 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.448 0.642 . . . . 0.0 109.68 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -138.23 159.36 42.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.712 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.59 148.38 35.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.631 174.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 35.5 tt0 -57.43 -42.76 83.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 176.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m -59.85 -32.67 70.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.189 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.66 -37.27 59.75 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.102 0.477 . . . . 0.0 110.393 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.511 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 85.8 mt -81.25 -18.99 44.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.957 -177.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 31.2 mmtp -65.15 -29.81 70.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.973 0.416 . . . . 0.0 110.996 177.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.09 2.52 79.27 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.358 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.43 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -103.19 137.78 40.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.778 0.323 . . . . 0.0 110.222 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -74.78 171.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.776 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.572 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -58.2 -36.97 73.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.073 -178.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.88 91.33 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.541 0.526 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 mp0 -57.41 -47.13 82.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.901 0.382 . . . . 0.0 110.382 177.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.587 ' O ' HG13 ' A' ' 74' ' ' ILE . 57.5 m80 -58.22 -41.63 84.52 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 177.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 43.4 mt-10 -59.57 -49.75 76.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.239 -178.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 p -63.99 -34.29 77.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.664 0.269 . . . . 0.0 111.259 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.7 mt -61.39 -54.88 29.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.16 0.505 . . . . 0.0 111.006 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.587 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.7 mt -75.34 -21.53 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.799 -174.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 73.9 m -64.57 -37.3 87.07 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -68.23 -34.26 75.91 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.179 175.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.473 HD13 HG21 ' A' ' 55' ' ' ILE . 42.8 tp -64.81 -37.63 88.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.775 175.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.36 23.16 5.84 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.728 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.523 ' HB3' HG22 ' A' ' 74' ' ' ILE . 3.9 tpt180 -125.31 131.65 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -66.02 116.12 29.74 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 121.513 0.673 . . . . 0.0 110.331 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -83.38 -5.33 11.01 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.827 2.352 . . . . 0.0 113.167 -175.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.5 t -77.57 -0.13 25.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.404 178.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -77.81 -15.89 58.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.413 0.625 . . . . 0.0 109.713 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -102.52 128.04 49.32 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.002 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -84.83 -26.02 27.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.905 0.383 . . . . 0.0 111.09 -173.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.521 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 30.4 p30 -126.01 169.75 12.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.332 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.29 -18.24 59.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.589 0.233 . . . . 0.0 111.271 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.09 -49.27 68.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.894 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -62.94 -32.62 73.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.823 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 46.4 mtt-85 -65.35 -40.02 93.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.987 178.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.0 mt -62.83 -47.44 92.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.199 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.92 -39.72 78.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.621 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.98 -45.39 77.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.791 0.329 . . . . 0.0 110.39 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.9 mt -66.21 -39.13 83.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.505 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 91' ' ' ILE . 56.3 mt -65.77 -30.05 70.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.833 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -80.56 -34.73 35.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.257 0.551 . . . . 0.0 110.32 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.66 -30.57 56.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.408 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.405 HG13 ' OD1' ' A' ' 56' ' ' ASN . 10.5 tt -69.44 -23.98 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 121.173 0.511 . . . . 0.0 109.794 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.4 t70 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.288 175.387 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.582 0.23 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 24' ' ' SER . 26.0 p -129.6 142.78 50.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.842 0.353 . . . . 0.0 111.288 177.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.518 ' O ' ' HA ' ' A' ' 24' ' ' SER . . . -118.52 140.93 49.11 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 36.3 ttpt -122.07 123.29 41.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.146 0.498 . . . . 0.0 111.412 -175.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.525 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 3.4 tm? -73.86 125.28 27.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.182 176.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.551 HD13 HG13 ' A' ' 42' ' ' ILE . 43.4 pt -112.12 -15.06 10.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.601 -178.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.463 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 83.2 tttt -140.99 113.66 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.632 0.253 . . . . 0.0 110.811 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.68 -5.69 5.5 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.232 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? 73.6 -53.75 0.69 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.086 0.554 . . . . 0.0 110.784 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.496 HG22 ' HG2' ' A' ' 20' ' ' ARG . 1.4 p -147.02 142.2 27.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.378 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -152.91 140.34 19.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -107.76 129.36 55.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.936 -177.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -126.84 101.2 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.373 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' MET . . . . . 0.515 ' SD ' HD21 ' A' ' 31' ' ' LEU . 65.9 mtt 56.05 32.98 21.03 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.666 176.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.35 -24.76 26.76 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.324 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.09 118.6 21.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 20.5 m -100.05 105.45 17.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.178 0.513 . . . . 0.0 111.053 -176.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.525 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 95.2 m-85 -92.44 153.25 19.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.016 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HG2' HG22 ' A' ' 11' ' ' THR . 83.3 mtt85 -133.57 153.91 51.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.412 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.51 111.06 0.8 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.994 0.426 . . . . 0.0 111.218 176.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.8 6.37 67.52 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.636 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 87.9 t -114.55 110.32 31.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.04 0.448 . . . . 0.0 111.139 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.532 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 24.8 p -86.7 114.94 23.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.686 174.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -110.51 159.27 17.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.4 p -67.45 135.23 52.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.949 0.404 . . . . 0.0 112.022 -175.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 31.4 m -129.76 144.08 51.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.188 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.555 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -66.21 167.89 17.23 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 123.24 2.626 . . . . 0.0 112.211 174.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -55.66 -40.28 72.05 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.421 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -75.57 -34.15 60.66 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.227 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.555 HD12 ' HD2' ' A' ' 28' ' ' PRO . 34.9 mt -75.99 -25.6 55.94 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.036 -179.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.48 -42.88 97.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.962 0.41 . . . . 0.0 110.087 176.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.96 -38.06 46.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.53 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -57.5 -43.5 84.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HB2' HD21 ' A' ' 43' ' ' LEU . 92.3 mt -84.72 -20.22 31.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.982 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -62.3 -36.6 82.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.357 0.598 . . . . 0.0 109.978 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 24.85 3.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.43 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -116.8 121.77 32.41 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.847 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.62 -32.63 93.56 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.274 2.649 . . . . 0.0 114.238 -174.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.463 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 6.1 p90 -99.24 23.27 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -131.16 120.34 23.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 111.453 175.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.551 HG13 HD13 ' A' ' 7' ' ' ILE . 71.4 mt -106.21 111.43 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.254 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.4 mp -91.8 169.14 10.94 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.8 m . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.89 178.432 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.534 ' O ' HG23 ' A' ' 73' ' ' ILE . 7.0 Cg_exo . . . . . 0 N--CA 1.46 -0.447 0 CA-C-O 120.364 0.068 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.554 HD12 HG23 ' A' ' 94' ' ' ILE . 11.0 tp 178.32 26.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 121.951 0.881 . . . . 0.0 109.763 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.482 ' HA ' HD11 ' A' ' 98' ' ' ILE . 25.2 p-10 -142.48 38.22 1.52 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.567 -170.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 75.2 m-85 -96.64 165.64 12.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.945 0.402 . . . . 0.0 111.482 -175.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.524 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 14.3 m -64.37 138.17 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.194 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -51.28 -54.1 29.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.12 0.485 . . . . 0.0 109.774 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.4 t -59.34 -34.43 72.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.731 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' MET . 34.6 tt0 -71.79 -42.13 67.48 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.055 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 57' ' ' TYR . 80.8 mt -65.37 -40.9 94.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.325 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HG3' HG12 ' A' ' 91' ' ' ILE . 98.7 mttt -68.22 -17.17 64.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.033 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.54 11.14 42.64 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.237 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 45.9 mtt -89.13 162.19 16.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.0 111.528 -179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.739 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 45.6 t-20 -71.2 145.98 49.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.202 174.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 14.2 tmtt? -53.69 -39.35 65.08 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.603 177.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.99 -28.03 67.93 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.742 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.739 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 23.1 mm-40 -64.35 -50.16 68.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 74' ' ' ILE . 64.8 m-70 -55.45 -42.49 74.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.916 176.569 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.542 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 45.6 mt-10 -58.51 -51.56 69.34 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.388 0.43 . . . . 0.0 110.352 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m -55.03 -42.11 72.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.509 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.534 HG23 ' O ' ' A' ' 54' ' ' PRO . 88.2 mt -57.7 -60.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.509 178.136 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.707 HG12 ' O ' ' A' ' 70' ' ' HIS . 3.1 pt -76.24 -13.92 14.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -174.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.7 m -72.59 -45.22 60.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -74.39 -30.2 61.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.524 HD22 HD13 ' A' ' 55' ' ' ILE . 33.4 tp -67.63 -34.2 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.41 36.06 3.67 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.17 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.555 ' HB3' ' HB ' ' A' ' 74' ' ' ILE . 30.7 tpt180 -115.55 -50.92 2.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.573 0.225 . . . . 0.0 110.523 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.6 t30 68.08 134.12 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.452 0 O-C-N 124.028 0.83 . . . . 0.0 111.16 -177.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.542 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 20.4 Cg_endo -81.05 61.98 8.39 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.457 2.105 . . . . 0.0 112.506 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.7 p -86.42 -17.81 33.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.549 -179.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -149.77 81.76 1.39 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 110.607 175.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 81' ' ' PRO . 85.3 m-85 -142.27 108.57 5.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.15 174.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -102.67 -28.07 12.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.084 -175.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.594 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 84.0 m-20 -107.11 152.69 23.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.757 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.58 -37.65 73.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -55.16 -41.49 71.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.707 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.594 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 48.2 mm-40 -59.88 -45.42 92.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.171 177.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -62.53 -46.79 86.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 63' ' ' LYS . 1.9 mp -66.52 -40.38 86.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.421 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.15 -40.53 90.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.493 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -71.04 -37.3 72.55 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.851 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.554 HG23 HD12 ' A' ' 55' ' ' ILE . 64.1 mt -70.72 -37.95 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.552 179.03 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.467 HD13 HD12 ' A' ' 98' ' ' ILE . 3.9 mm? -71.98 -18.71 61.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.133 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -60.9 -43.73 98.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -69.95 -37.35 75.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.661 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.482 HD11 ' HA ' ' A' ' 56' ' ' ASN . 64.2 mt -64.34 -41.61 92.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.56 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.606 176.934 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.418 ' O ' ' HA ' ' A' ' 26' ' ' THR . 56.0 m-85 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 25' ' ' GLN . 14.3 p -113.59 123.08 49.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.956 0.408 . . . . 0.0 110.823 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.98 135.06 49.19 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.136 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 28.7 ttpp -126.53 122.78 36.11 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.42 -178.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -63.95 117.4 6.96 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.745 HG13 ' HG3' ' A' ' 8' ' ' LYS . 33.7 pt -106.12 -27.21 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.593 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.745 ' HG3' HG13 ' A' ' 7' ' ' ILE . 29.9 mtpp -117.36 100.58 7.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.334 -177.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.8 -120.92 1.82 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.567 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.486 ' HG3' ' H ' ' A' ' 11' ' ' THR . 20.8 pttp -176.21 -56.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -174.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.486 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.5 p -142.21 119.22 11.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.206 -178.17 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -154.51 124.2 6.61 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.55 135.92 49.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.998 0.428 . . . . 0.0 110.631 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 35' ' ' LEU . 58.5 t -107.3 107.03 21.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.944 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.9 mtt 65.66 -75.25 0.05 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.972 0.795 . . . . 0.0 111.334 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -138.76 -3.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.82 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -101.15 115.32 42.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -91.05 112.14 23.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.155 -174.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.44 153.81 19.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.269 0.556 . . . . 0.0 111.322 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -131.79 150.98 51.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.427 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -57.91 111.65 1.23 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.769 0.319 . . . . 0.0 110.841 175.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.76 -8.66 43.35 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.543 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -104.3 119.39 53.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.809 0.338 . . . . 0.0 110.654 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.549 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 20.4 p -102.72 123.08 45.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.204 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 3' ' ' THR . 48.9 mt-30 -127.65 157.78 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.655 0.265 . . . . 0.0 111.134 -178.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 0.8 OUTLIER -71.83 128.81 36.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.605 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 34.1 m -123.95 145.84 49.14 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.684 178.077 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.553 ' HD2' HD12 ' A' ' 31' ' ' LEU . 26.0 Cg_exo -63.5 156.89 53.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.711 2.274 . . . . 0.0 111.356 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -53.94 -36.07 62.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.53 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.45 -44.68 95.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.553 HD12 ' HD2' ' A' ' 28' ' ' PRO . 76.4 mt -78.26 -26.81 47.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.764 0.316 . . . . 0.0 110.613 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -57.63 -48.33 79.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.391 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -77.1 -30.76 55.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.041 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -61.31 -46.15 91.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.107 176.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.418 HD21 HG21 ' A' ' 14' ' ' VAL . 82.8 mt -77.97 -19.55 54.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.247 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -65.53 -28.08 68.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.31 0.576 . . . . 0.0 110.079 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -90.64 10.64 24.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.951 176.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 46.0 m-80 -135.02 97.44 13.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.359 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -71.81 28.07 0.24 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.788 2.992 . . . . 0.0 114.904 -169.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.7 p90 -112.37 9.65 19.81 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.484 -0.487 . . . . 0.0 111.044 175.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.416 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 42.9 m-85 -123.64 140.99 52.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.342 171.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.8 tt -97.18 126.66 49.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 171.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.01 103.98 13.63 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.623 -174.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.9 m . . . . . 0 C--N 1.318 -0.8 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.417 -177.397 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.483 ' O ' HG22 ' A' ' 55' ' ' ILE . 98.3 Cg_endo . . . . . 0 N--CA 1.46 -0.485 0 N-CA-C 113.121 0.393 . . . . 0.0 113.121 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.517 HD11 ' HG3' ' A' ' 97' ' ' GLN . 7.2 tp 52.61 25.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.433 1.093 . . . . 0.0 111.738 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -157.02 92.66 1.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.988 -175.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -142.77 159.95 41.26 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 60' ' ' SER . 3.2 m -67.98 145.03 54.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.055 174.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.426 ' HB2' HD11 ' A' ' 95' ' ' LEU . 2.4 tm-20 -56.54 -31.64 64.34 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 171.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 58' ' ' THR . 14.9 m -60.05 -38.75 83.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.456 172.285 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.26 -36.25 24.69 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.21 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.0 mt -72.76 -16.86 61.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.41 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.594 ' HD2' HD13 ' A' ' 91' ' ' ILE . 0.6 OUTLIER -63.45 -36.03 82.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.453 176.663 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.43 -135.23 5.2 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.068 -176.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm 61.77 -166.88 0.21 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 122.896 0.478 . . . . 0.0 110.124 -173.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -106.26 162.2 13.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.453 ' HE2' ' HB2' ' A' ' 67' ' ' LYS . 3.5 mppt? -69.63 -33.44 72.63 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 121.343 -0.143 . . . . 0.0 110.73 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.37 -46.04 46.63 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.793 0.683 . . . . 0.0 112.394 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.6 mp0 -57.63 -55.99 27.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 110.068 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.537 ' HA ' HD12 ' A' ' 73' ' ' ILE . 25.4 m80 -55.58 -47.75 75.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.998 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.49 -50.97 70.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.424 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.4 m -56.93 -37.83 72.03 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.316 0.579 . . . . 0.0 110.825 -178.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.537 HD12 ' HA ' ' A' ' 70' ' ' HIS . 88.0 mt -60.8 -60.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.544 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -70.18 -29.04 38.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.113 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.508 ' HA ' ' OD1' ' A' ' 80' ' ' ASN . 13.6 p -67.17 -32.78 74.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.839 0.352 . . . . 0.0 110.659 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -87.46 -18.05 30.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.878 0.37 . . . . 0.0 110.942 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.8 -37.75 67.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.045 175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 126.25 -13.71 7.02 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.208 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.459 ' O ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -113.93 80.35 1.37 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.206 0.527 . . . . 0.0 110.244 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.508 ' OD1' ' HA ' ' A' ' 75' ' ' SER . 77.2 m-20 -52.64 139.72 39.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.101 178.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' ' HB2' ' A' ' 84' ' ' PHE . 61.1 Cg_endo -75.3 51.19 2.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.976 2.451 . . . . 0.0 113.006 -178.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.6 m -71.13 -51.06 27.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.874 0.369 . . . . 0.0 110.504 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -100.37 -6.22 26.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.122 0.486 . . . . 0.0 110.429 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 81' ' ' PRO . 97.2 m-85 -90.79 108.66 19.97 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -145.2 -39.21 0.25 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.137 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.75 139.96 57.84 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.562 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' ARG . . . -52.55 -52.89 52.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -74.63 -25.5 59.27 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.691 -174.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.84 -39.84 76.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.438 0.637 . . . . 0.0 109.978 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 87' ' ' ALA . 12.1 ttm180 -54.48 -54.2 44.07 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.417 174.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.594 HD13 ' HD2' ' A' ' 63' ' ' LYS . 47.4 mt -61.67 -42.66 95.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.685 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.11 74.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.867 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -65.45 -48.17 73.62 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.865 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.27 -34.91 72.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.511 -176.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' A' ' 59' ' ' GLU . 29.2 mt -65.7 -39.45 91.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.008 176.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -68.63 -17.34 64.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.199 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.517 ' HG3' HD11 ' A' ' 55' ' ' ILE . 29.8 mm-40 -73.43 -24.8 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 176.059 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -86.59 -47.19 16.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.348 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.395 -179.732 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.882 0.373 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.401 ' CG2' ' HB3' ' A' ' 24' ' ' SER . 12.5 m -138.62 127.47 23.71 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.381 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.95 138.88 44.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HD3' ' OG ' ' A' ' 24' ' ' SER . 34.9 ttpt -129.79 116.51 18.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -65.9 124.96 23.91 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.728 HG13 ' HG3' ' A' ' 8' ' ' LYS . 18.7 pt -117.18 -38.31 2.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.369 . . . . 0.0 111.319 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.728 ' HG3' HG13 ' A' ' 7' ' ' ILE . 61.5 mtpt -100.67 90.66 4.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.058 0.456 . . . . 0.0 110.243 -177.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.43 -137.22 6.47 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.697 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 10' ' ' LYS . 46.0 mtpt -154.25 -55.62 0.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.1 m -149.88 131.86 15.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.058 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -143.21 123.68 13.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.1 -177.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -85.17 117.58 24.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.93 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.0 t -114.41 106.25 20.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 176.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.73 -91.37 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.845 -177.142 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.98 6.79 6.43 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.8 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.467 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.0 mp -108.89 129.74 62.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.243 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -98.61 105.81 18.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.97 0.414 . . . . 0.0 110.878 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -87.49 143.51 27.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.487 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -133.9 144.22 48.74 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.288 178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -50.02 119.32 3.5 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.628 0.58 . . . . 0.0 112.033 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 -4.67 63.48 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.591 -0.731 . . . . 0.0 113.266 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -106.74 114.15 45.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 117.112 0.456 . . . . 0.0 111.669 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.406 ' OG ' ' HD3' ' A' ' 5' ' ' LYS . 41.4 m -79.12 130.97 36.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.107 171.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -129.78 139.3 51.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.772 0.32 . . . . 0.0 110.76 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -72.62 108.61 5.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 m -109.37 154.68 42.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.175 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.531 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.2 Cg_exo -67.37 164.39 30.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.955 2.436 . . . . 0.0 111.866 174.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -58.01 -40.04 79.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.564 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.47 -48.91 73.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.463 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD12 ' HD2' ' A' ' 28' ' ' PRO . 59.1 mt -67.47 -27.37 66.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.171 -176.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -58.9 -48.38 81.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.847 0.356 . . . . 0.0 110.137 175.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.39 -37.36 63.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.749 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 80.5 t80 -55.82 -42.98 76.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.734 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.504 HD22 ' CE1' ' A' ' 41' ' ' PHE . 87.2 mt -85.75 -18.96 31.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.991 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -61.48 -30.86 70.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.347 0.594 . . . . 0.0 109.838 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -82.81 -0.52 48.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.745 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -121.23 114.43 31.98 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.897 0.379 . . . . 0.0 110.951 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -78.16 44.58 1.62 Allowed 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 123.149 2.566 . . . . 0.0 113.542 -173.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -105.16 -15.53 15.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 110.297 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.504 ' CE1' HD22 ' A' ' 35' ' ' LEU . 35.9 m-85 -123.08 153.45 39.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.402 -167.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.577 HG12 HD13 ' A' ' 7' ' ' ILE . 25.9 mm -101.57 108.61 23.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 162.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -90.02 118.64 29.72 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.278 0.561 . . . . 0.0 110.083 -177.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 m . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.211 -175.701 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.512 ' O ' HG22 ' A' ' 55' ' ' ILE . 84.6 Cg_endo . . . . . 0 N--CA 1.45 -1.041 0 N-CA-C 112.912 0.312 . . . . 0.0 112.912 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.813 HG21 HD13 ' A' ' 77' ' ' LEU . 3.8 tp 59.41 23.75 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 115.305 -0.861 . . . . 0.0 113.049 169.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -136.64 38.49 2.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.211 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.479 ' HB2' HD21 ' A' ' 62' ' ' LEU . 68.6 m-85 -94.92 155.94 16.55 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.569 -178.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.573 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -57.53 127.01 29.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.748 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.748 ' HB3' ' HG ' ' A' ' 95' ' ' LEU . 1.9 pp20? -62.79 -26.19 68.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.142 0.496 . . . . 0.0 110.289 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 p -71.59 -30.73 66.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.948 174.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 30.3 mm-40 -79.49 -40.7 29.12 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.561 175.237 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD21 ' HB2' ' A' ' 57' ' ' TYR . 92.3 mt -62.96 -20.93 65.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.153 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.614 ' HD3' HD13 ' A' ' 91' ' ' ILE . 0.1 OUTLIER -64.69 -33.46 76.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.916 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.95 -24.04 13.9 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.536 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 24.1 mmt -53.89 138.51 36.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.919 0.39 . . . . 0.0 110.99 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -84.47 -174.79 5.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.298 0.57 . . . . 0.0 111.836 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 63.2 tttm -59.34 -54.41 47.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.421 -178.13 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.59 84.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.795 -174.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 73' ' ' ILE . 49.1 mt-10 -63.99 -51.46 64.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.517 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.561 ' O ' HG13 ' A' ' 74' ' ' ILE . 26.7 m-70 -55.31 -43.11 74.56 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.095 175.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.575 ' HG2' ' HG2' ' A' ' 81' ' ' PRO . 46.0 mt-10 -60.17 -45.23 93.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.963 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -65.21 -45.04 86.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.744 0.307 . . . . 0.0 110.475 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 69' ' ' GLU . 97.8 mt -55.37 -56.54 11.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.993 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.1 mt -75.02 -25.75 18.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.065 -172.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.9 m -71.56 -27.18 62.98 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.111 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -69.88 -33.25 71.97 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 171.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.813 HD13 HG21 ' A' ' 55' ' ' ILE . 42.3 tp -67.17 -37.64 84.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.182 173.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 123.03 22.4 2.4 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.877 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -146.74 126.09 13.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 111.217 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 17.2 m120 -80.09 137.6 53.18 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.122 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.575 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 8.7 Cg_endo -84.39 48.68 2.52 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.599 2.199 . . . . 0.0 112.237 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.1 p -85.95 -36.08 20.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.656 175.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -66.3 -35.56 80.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.128 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -96.03 108.65 21.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.302 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -94.45 -26.41 16.49 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.993 0.425 . . . . 0.0 110.783 -174.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.507 ' HB3' ' CD ' ' A' ' 89' ' ' GLU . 53.2 t30 -99.09 151.34 21.07 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.107 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -65.36 -32.68 74.44 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -177.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.38 -55.63 32.31 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.589 0.233 . . . . 0.0 111.386 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.507 ' CD ' ' HB3' ' A' ' 86' ' ' ASN . 1.1 pm0 -60.5 -34.25 73.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.284 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.429 ' O ' HG13 ' A' ' 94' ' ' ILE . 97.5 mtt180 -64.6 -44.24 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.429 177.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.614 HD13 ' HD3' ' A' ' 63' ' ' LYS . 80.7 mt -66.05 -44.87 91.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.127 177.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.33 96.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.5 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 49.2 t80 -64.4 -42.36 96.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.455 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -69.73 -40.79 79.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 0.0 110.134 177.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.748 ' HG ' ' HB3' ' A' ' 59' ' ' GLU . 0.5 OUTLIER -57.66 -46.1 84.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.813 -179.623 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -76.42 -3.84 39.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -174.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.673 ' HG3' HG12 ' A' ' 55' ' ' ILE . 76.3 mm-40 -80.17 -30.15 38.8 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.4 mt -74.72 -34.88 35.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.591 174.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.779 178.965 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 mmt . . . . . 0 N--CA 1.48 1.05 0 CA-C-O 120.567 0.222 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 40.4 m-85 -105.17 142.24 35.3 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 t -144.14 146.23 32.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.969 0.414 . . . . 0.0 110.604 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.54 145.68 51.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.389 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -134.78 129.62 34.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.915 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.784 HD22 ' H ' ' A' ' 9' ' ' GLY . 2.8 mt -64.09 117.8 7.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -177.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.494 HG21 ' HB ' ' A' ' 42' ' ' ILE . 42.5 pt -108.39 -28.51 2.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.15 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 40' ' ' TYR . 49.1 tptt -88.91 -34.33 16.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.11 -177.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.784 ' H ' HD22 ' A' ' 6' ' ' LEU . . . -105.13 -157.77 23.06 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.672 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 73.3 mmtt -139.9 -41.76 0.43 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.464 HG23 ' HG2' ' A' ' 20' ' ' ARG . 25.4 m -152.34 114.4 4.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.88 172.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CB ' HD11 ' A' ' 6' ' ' LEU . 29.6 t80 -136.31 139.14 42.39 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.685 0.278 . . . . 0.0 110.358 -172.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -106.95 112.39 25.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.962 0.411 . . . . 0.0 110.271 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 35' ' ' LEU . 78.8 t -102.09 104.34 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 45.2 ttm 65.71 -79.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.742 0.651 . . . . 0.0 110.668 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.38 10.92 2.74 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.1 mm -108.03 139.63 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 m -108.95 113.27 26.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.929 0.395 . . . . 0.0 111.137 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -107.4 148.86 28.56 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.239 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 11' ' ' THR . 31.2 mtp85 -133.01 143.29 49.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 175.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 9' ' ' GLY . . . -55.28 127.21 28.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.955 0.407 . . . . 0.0 111.317 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.83 -13.28 67.79 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.162 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -103.77 113.49 40.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.703 0.287 . . . . 0.0 110.842 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.3 m -85.53 136.3 33.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 -138.05 134.32 34.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -70.39 130.55 42.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.52 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 34.0 m -126.74 155.43 75.14 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.881 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.543 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.2 Cg_exo -70.88 166.69 28.15 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.855 2.37 . . . . 0.0 111.469 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -56.7 -36.91 70.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -56.33 -51.16 69.27 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.035 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.543 HD12 ' HD2' ' A' ' 28' ' ' PRO . 83.0 mt -73.77 -30.11 62.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.044 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -59.16 -46.85 87.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.584 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -80.55 -27.2 37.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.33 -41.76 98.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 173.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 41' ' ' PHE . 79.4 mt -85.33 -8.21 58.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.605 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.431 ' HA ' HD11 ' A' ' 43' ' ' LEU . 15.4 t30 -72.12 -32.2 66.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 172.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -75.98 -39.03 56.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.728 172.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.601 ' HB3' ' HD1' ' A' ' 40' ' ' TYR . 33.1 m-80 -86.44 108.9 19.69 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.548 -175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.18 44.84 1.68 Allowed 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.072 2.514 . . . . 0.0 113.541 -174.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.601 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 63.0 m-85 -102.41 -16.65 16.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 110.951 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.497 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 64.4 m-85 -125.35 158.84 33.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.004 0.431 . . . . 0.0 111.61 -169.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.494 ' HB ' HG21 ' A' ' 7' ' ' ILE . 15.8 tt -97.05 131.64 43.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 165.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.431 HD11 ' HA ' ' A' ' 36' ' ' ASN . 69.8 mt -108.58 134.41 51.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.398 0.618 . . . . 0.0 111.091 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.7 m -144.43 133.35 22.6 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.69 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -127.4 130.11 48.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.918 0.389 . . . . 0.0 110.044 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.15 151.74 51.97 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.572 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.12 106.08 16.42 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.814 -177.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -74.49 -36.99 63.28 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -87.42 88.7 7.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.666 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -76.8 -55.15 5.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.01 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -136.9 121.45 18.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.748 176.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.494 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t70 -112.18 -156.54 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 172.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -96.74 98.95 4.96 Favored Pre-proline 0 C--N 1.318 -0.793 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' A' ' 76' ' ' ASN . 56.6 Cg_endo -89.33 76.41 1.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.06 2.507 . . . . 0.0 112.701 -171.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.758 HG12 HD22 ' A' ' 77' ' ' LEU . 8.5 tp -169.65 27.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 122.247 1.022 . . . . 0.0 109.438 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -160.54 109.43 1.67 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.016 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -142.07 174.84 10.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.497 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -64.17 129.43 39.94 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.3 pp20? -60.27 -31.32 70.11 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -62.02 -37.95 86.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.119 174.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -29.6 42.84 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 120.566 -0.453 . . . . 0.0 110.39 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 65' ' ' MET . 92.1 mt -79.9 -20.25 46.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.102 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 30.2 mmtp -68.04 -30.96 70.31 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.278 0.561 . . . . 0.0 109.962 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.49 26.17 13.77 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.621 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.595 ' HG3' ' HB2' ' A' ' 69' ' ' GLU . 44.0 tpp -104.29 135.48 45.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.703 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 5.6 m-20 -71.92 170.03 14.62 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.782 0.801 . . . . 0.0 112.958 -171.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -58.21 8.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.769 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.45 -24.66 65.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.916 0.389 . . . . 0.0 111.126 -175.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.703 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 8.7 mm-40 -65.04 -54.08 35.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.998 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.527 ' O ' HG13 ' A' ' 74' ' ' ILE . 44.0 m-70 -53.66 -40.66 66.08 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 176.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.97 -49.22 62.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.623 -176.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 p -61.08 -35.83 78.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.63 0.252 . . . . 0.0 110.874 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 69' ' ' GLU . 94.0 mt -55.7 -61.6 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.104 0.478 . . . . 0.0 110.91 175.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.63 ' HA ' HD13 ' A' ' 55' ' ' ILE . 5.7 mt -70.93 -21.38 22.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -173.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 57.9 m -67.7 -35.08 78.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.843 0.354 . . . . 0.0 110.237 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.562 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 17.9 m-80 -72.13 -28.32 63.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.406 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.758 HD22 HG12 ' A' ' 55' ' ' ILE . 42.0 tp -64.43 -34.86 79.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.349 172.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 19.43 10.5 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.924 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 159.64 20.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -95.23 107.16 30.49 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.852 0.358 . . . . 0.0 110.627 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.525 ' HB3' HD12 ' A' ' 74' ' ' ILE . 83.9 Cg_endo -82.91 12.78 2.83 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.333 . . . . 0.0 112.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.6 p -77.89 -25.74 48.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.24 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.77 -37.54 59.16 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.087 0.47 . . . . 0.0 109.879 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -81.98 108.59 15.6 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -105.29 -29.59 10.2 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -170.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -89.68 153.24 20.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.84 0.353 . . . . 0.0 110.601 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.8 91.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -54.64 -48.79 71.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.94 -50.51 73.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.409 0.623 . . . . 0.0 110.807 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -67.24 -39.94 86.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.016 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.403 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.3 mt -70.05 -44.24 78.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.681 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.02 -42.4 99.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 0.0 111.335 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.24 -40.55 96.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.51 -34.89 71.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 178.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.632 ' O ' HG22 ' A' ' 98' ' ' ILE . 53.3 mt -67.36 -23.7 65.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.567 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -30.18 71.3 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.318 176.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 55' ' ' ILE . 2.2 mp0 -88.27 -25.07 23.01 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.395 -178.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 95' ' ' LEU . 8.3 tp -70.47 -22.18 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 173.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -81.53 -25.09 36.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.405 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 97' ' ' GLN . 5.9 m-80 -78.59 -19.81 51.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.238 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -83.14 81.62 8.61 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 170.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.02 -40.91 4.75 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.055 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -134.06 155.95 49.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.331 0.586 . . . . 0.0 111.803 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -126.02 -58.57 1.37 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.588 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -93.06 72.98 4.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.778 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -87.5 5.85 37.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.627 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -89.12 147.33 24.27 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.579 -176.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.2 p-80 -77.0 175.2 9.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.525 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 67.63 9.24 6.92 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.525 0.679 . . . . 0.0 110.431 -176.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.31 62.67 0.76 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.136 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 80.2 t60 . . . . . 0 C--O 1.245 0.857 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.64 -175.179 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.637 ' HB2' ' HB2' ' A' ' 46' ' ' GLU . 81.3 mtp . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 120.568 0.223 . . . . 0.0 110.633 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -97.87 103.46 15.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 85.1 m -112.74 130.36 56.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.205 0.526 . . . . 0.0 111.314 -174.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -114.21 146.1 40.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.176 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.408 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 36.1 ttpt -133.97 129.62 36.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.387 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -67.78 118.94 11.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.677 HG13 ' HG3' ' A' ' 8' ' ' LYS . 38.4 pt -109.25 -25.66 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.591 -176.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.677 ' HG3' HG13 ' A' ' 7' ' ' ILE . 99.2 mttt -122.06 96.79 5.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 0.0 111.115 -177.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.22 -118.52 0.99 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.878 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 2.2 ttmp? -175.61 -58.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.469 HG22 ' HG2' ' A' ' 20' ' ' ARG . 4.0 p -141.26 118.11 11.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.28 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -136.35 133.41 36.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.918 0.389 . . . . 0.0 110.634 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -97.24 110.5 23.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.892 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.83 92.01 3.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 173.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 35.1 mtm 62.78 -86.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.688 -176.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -124.23 12.54 8.02 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.536 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.8 mp -120.46 125.3 73.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.734 0.267 . . . . 0.0 110.478 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.4 m -89.95 109.36 20.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.516 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.469 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 81.0 m-85 -92.83 131.2 38.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.995 176.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HG2' HG22 ' A' ' 11' ' ' THR . 80.7 mtt180 -114.79 143.72 44.63 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.22 115.03 2.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.184 178.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.16 -9.49 59.58 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.837 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.9 t -100.72 115.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.881 0.372 . . . . 0.0 110.969 -178.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m -84.95 136.32 33.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.308 176.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.415 ' C ' HG23 ' A' ' 3' ' ' THR . 97.4 mt-30 -141.08 128.21 20.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.208 -177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.5 m -72.72 127.13 31.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.821 0.343 . . . . 0.0 110.273 178.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 m -118.68 163.43 25.81 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.685 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.7 Cg_exo -69.09 155.76 67.16 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.445 2.096 . . . . 0.0 110.576 169.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -63.94 -24.24 67.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.565 0.221 . . . . 0.0 111.275 -175.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -55.21 -41.45 72.04 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.12 0.486 . . . . 0.0 110.275 171.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.9 mt -84.32 -21.93 30.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.84 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.19 -47.38 80.02 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.95 -36.64 75.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.506 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.86 -39.88 95.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.842 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.7 mt -85.15 -12.08 53.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 178.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -68.26 -33.54 74.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -73.96 -15.1 61.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.953 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -122.44 86.43 48.47 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -71.91 13.59 0.48 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.367 2.711 . . . . 0.0 114.611 -168.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.54 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 15.5 p90 -90.93 14.83 12.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.467 0.651 . . . . 0.0 110.515 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.471 ' CE1' HD22 ' A' ' 35' ' ' LEU . 88.8 m-85 -118.26 148.4 42.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.702 169.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.478 ' HB ' HG21 ' A' ' 7' ' ' ILE . 16.5 tt -97.45 129.88 46.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -107.34 114.63 28.79 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.234 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.6 m -126.45 126.49 43.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.64 -176.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -89.91 124.64 34.88 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.088 177.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.637 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 42.8 mt-10 -101.58 117.21 34.45 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 83.7 mt -119.41 99.9 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.337 -174.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 58.5 t30 74.45 146.9 0.09 Allowed 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.054 0.846 . . . . 0.0 112.386 171.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -122.71 -22.1 5.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.26 178.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -91.62 107.73 19.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.2 -173.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -120.78 58.22 0.95 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.477 0.656 . . . . 0.0 109.946 168.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -93.93 16.87 13.3 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 168.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 63.66 81.05 0.23 Allowed Pre-proline 0 C--O 1.232 0.18 0 CA-C-N 113.665 -1.607 . . . . 0.0 109.439 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.641 ' O ' HG23 ' A' ' 73' ' ' ILE . 94.8 Cg_endo -77.41 37.72 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.615 2.877 . . . . 0.0 113.071 -172.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tp -145.06 24.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 122.395 1.093 . . . . 0.0 108.084 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -144.66 94.42 2.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.876 -173.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB2' HD11 ' A' ' 62' ' ' LEU . 77.3 m-85 -141.51 160.6 39.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.235 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.524 HG22 ' H ' ' A' ' 60' ' ' SER . 9.4 m -65.45 126.52 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.005 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -64.61 -26.91 68.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.222 0.534 . . . . 0.0 109.642 177.845 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 58' ' ' THR . 9.2 m -68.72 -30.05 68.6 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.609 175.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 13.3 mm-40 -82.1 -44.21 16.82 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.948 0.404 . . . . 0.0 110.341 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 57' ' ' TYR . 88.1 mt -69.03 -12.69 61.91 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.549 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.7 OUTLIER -67.78 -53.61 25.82 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.472 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.67 57.96 1.89 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.734 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.435 ' HG3' ' HA ' ' A' ' 62' ' ' LEU . 12.0 mmt -120.0 -169.49 1.79 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.583 0.706 . . . . 0.0 111.42 -177.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.482 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 39.0 t30 -100.14 -166.35 1.32 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.829 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' H ' ' CG ' ' A' ' 66' ' ' ASN . 1.4 ttpm? -100.6 -36.98 8.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.767 0.317 . . . . 0.0 110.561 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.505 ' HA ' ' OE1' ' A' ' 71' ' ' GLU . . . -62.78 -36.45 83.14 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -74.7 -39.39 61.98 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.032 -176.424 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.539 ' HA ' HD12 ' A' ' 73' ' ' ILE . 64.6 m80 -56.1 -42.78 77.33 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 120.621 0.248 . . . . 0.0 110.814 172.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 42.0 mt-10 -60.72 -46.72 89.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.229 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 76' ' ' ASN . 22.8 m -67.77 -31.42 71.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.126 178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 54' ' ' PRO . 30.7 mt -58.44 -57.6 10.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.527 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -86.64 -11.83 11.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.97 -171.735 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 p -81.03 -34.57 32.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 72' ' ' SER . 4.4 t-20 -65.18 -34.58 78.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.608 0.718 . . . . 0.0 109.265 174.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.564 HD21 ' NE2' ' A' ' 97' ' ' GLN . 53.4 tp -63.25 -25.16 68.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.997 175.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.97 11.29 60.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.241 -177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.613 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 1.6 tpm_? -93.0 -35.57 13.2 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 122.9 -0.177 . . . . 0.0 110.832 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 38.3 t30 70.45 108.96 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.721 0.638 . . . . 0.0 111.055 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.558 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 2.9 Cg_exo -75.16 65.17 6.21 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.953 2.435 . . . . 0.0 112.943 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 t -92.37 -29.21 16.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.389 . . . . 0.0 110.631 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.29 -23.96 32.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.259 0.552 . . . . 0.0 111.131 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 59.5 m-85 -82.44 126.73 32.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.878 -172.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -108.76 -57.82 2.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.563 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -89.7 154.34 20.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.445 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -61.04 -30.82 70.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.648 0.261 . . . . 0.0 110.63 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.58 -54.29 39.51 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.311 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.41 -37.38 70.11 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.308 0.575 . . . . 0.0 110.634 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.3 mtt-85 -68.25 -45.74 72.38 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.422 -178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 87' ' ' ALA . 75.4 mt -65.13 -43.67 95.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.621 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.5 80.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.484 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -71.26 -43.42 67.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.209 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 90' ' ' ARG . 91.7 mt -59.45 -43.03 89.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.133 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.525 HD23 HD12 ' A' ' 98' ' ' ILE . 19.1 mt -57.52 -39.04 75.68 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.281 174.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -68.33 -27.58 66.4 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.001 -174.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.564 ' NE2' HD21 ' A' ' 77' ' ' LEU . 0.4 OUTLIER -83.37 -19.56 35.87 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.69 178.425 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.525 HD12 HD23 ' A' ' 95' ' ' LEU . 71.0 mt -67.48 -42.06 86.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 170.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -62.61 -40.73 97.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.684 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -90.44 17.83 6.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.747 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -83.12 80.35 9.08 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.1 61.72 4.09 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.857 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -98.2 21.27 11.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.755 0.788 . . . . 0.0 109.193 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.622 ' HA ' ' HB2' ' A' ' 108' ' ' HIS . 78.6 mt -84.3 76.48 10.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.651 -178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -86.17 94.37 9.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.978 178.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 66.3 m-70 52.3 58.05 5.81 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.405 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 106' ' ' HIS . 32.5 m170 70.81 110.36 0.06 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.307 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.622 ' HB2' ' HA ' ' A' ' 104' ' ' LEU . 16.1 t-80 -81.82 93.48 6.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.653 -175.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -167.33 -21.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.781 -178.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 77.24 109.49 0.08 Allowed 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.781 0.675 . . . . 0.0 112.076 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.0 173.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptt? . . . . . 0 N--CA 1.481 1.101 0 CA-C-O 120.782 0.325 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.518 ' O ' ' HA ' ' A' ' 26' ' ' THR . 76.3 m-85 -134.85 153.03 52.21 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.495 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -104.69 122.27 45.31 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.963 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.65 133.0 56.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.1 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -132.35 133.97 44.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.237 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.567 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 2.8 mt -67.07 125.36 25.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.157 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.661 HG13 ' HG3' ' A' ' 8' ' ' LYS . 32.0 pt -111.64 -15.77 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.109 0.481 . . . . 0.0 110.676 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.661 ' HG3' HG13 ' A' ' 7' ' ' ILE . 67.5 mttm -130.14 134.0 47.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.298 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.96 -124.44 7.52 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.052 175.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -160.99 -59.64 0.05 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.975 0.416 . . . . 0.0 109.937 -171.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.498 HG23 ' HG2' ' A' ' 20' ' ' ARG . 32.6 m -153.08 121.15 6.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.278 -178.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -133.98 126.05 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -98.3 117.98 33.91 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.323 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.701 HG21 HD21 ' A' ' 35' ' ' LEU . 21.4 t -111.91 106.14 20.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.673 -178.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 38.1 tpp 71.38 -1.52 2.73 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.634 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.36 -29.0 3.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.65 -177.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.498 HD13 HD11 ' A' ' 31' ' ' LEU . 2.2 mp -82.44 119.93 32.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.0 m -90.01 114.79 26.71 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.078 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -100.08 143.18 30.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.015 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' A' ' 11' ' ' THR . 51.6 mtm180 -124.28 142.24 51.42 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -53.02 113.64 1.17 Allowed 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.426 0.454 . . . . 0.0 111.377 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.58 -13.99 27.5 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.927 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.1 t -104.69 111.31 33.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.964 0.382 . . . . 0.0 111.602 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.495 ' HB3' HG22 ' A' ' 3' ' ' THR . 20.1 m -79.43 137.03 37.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.586 173.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.22 151.83 44.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.518 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 7.6 p -82.97 124.01 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.187 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 21.3 m -118.37 154.34 52.06 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.927 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 27' ' ' VAL . 15.2 Cg_exo -73.56 173.51 13.75 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.773 2.982 . . . . 0.0 113.348 176.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -49.47 -46.6 48.27 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.667 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.8 mmtm -57.59 -53.8 54.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.095 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 45.5 mt -67.48 -33.88 76.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -175.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -59.69 -40.96 89.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -79.96 -38.37 32.45 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.417 0.627 . . . . 0.0 110.352 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -39.77 91.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.274 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.701 HD21 HG21 ' A' ' 14' ' ' VAL . 91.6 mt -85.06 -19.12 32.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.714 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -62.06 -32.41 72.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.75 175.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -85.7 3.09 42.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.908 176.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -131.17 94.76 26.59 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.78 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.3 34.48 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.452 2.768 . . . . 0.0 114.621 -169.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.538 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.2 p90 -112.5 8.88 19.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.678 0.751 . . . . 0.0 110.515 172.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.453 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 61.1 m-85 -115.01 148.14 39.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.369 168.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.596 ' HB ' HG21 ' A' ' 7' ' ' ILE . 11.2 tp -96.99 122.77 48.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.254 170.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.9 mt -105.01 114.91 29.39 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.862 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.9 m -126.74 123.71 38.08 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.212 0.529 . . . . 0.0 110.512 -178.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.471 ' CD ' ' H ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -90.01 104.74 17.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.833 177.511 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.402 ' HB3' ' OD1' ' A' ' 49' ' ' ASN . 45.0 mt-10 -106.04 129.88 54.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.403 -177.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.07 113.45 12.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.596 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 69.26 13.69 8.56 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.097 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.402 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 9.7 m120 -91.07 147.94 22.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.905 0.383 . . . . 0.0 110.636 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -132.57 -149.82 0.39 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.362 -177.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -81.02 76.03 7.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.384 0.612 . . . . 0.0 109.977 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -84.02 95.74 8.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.511 176.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 2.3 m-20 -66.31 114.74 18.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.517 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.501 ' O ' HG22 ' A' ' 55' ' ' ILE . 5.4 Cg_exo -79.64 157.52 24.92 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.986 2.457 . . . . 0.0 111.988 177.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.534 HG12 HD22 ' A' ' 77' ' ' LEU . 7.6 tp 54.35 26.15 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.315 1.046 . . . . 0.0 112.163 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -148.54 88.42 1.63 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.146 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -142.64 152.62 42.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.947 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 1.016 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.4 m -59.29 130.89 49.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.411 175.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 16.9 pt-20 -61.88 -35.27 77.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.135 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 p -66.57 -30.28 70.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 174.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 1.016 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 55.9 mm-40 -72.54 -39.55 67.41 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.61 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.536 HD23 ' SD ' ' A' ' 65' ' ' MET . 83.2 mt -74.86 -14.46 60.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.386 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 65.3 mmtt -65.12 -47.28 77.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.821 0.343 . . . . 0.0 110.649 177.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.31 53.94 1.8 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.494 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.536 ' SD ' HD23 ' A' ' 62' ' ' LEU . 95.7 mtp -138.09 162.01 35.29 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -94.87 168.54 10.74 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 20.6 pttp -74.28 -27.35 60.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -169.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.07 -49.48 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.2 mp0 -57.94 -51.49 69.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.707 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.505 ' O ' HG13 ' A' ' 74' ' ' ILE . 79.9 m80 -49.89 -40.43 42.84 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.553 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 56.4 mt-10 -65.8 -45.33 82.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.209 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.7 p -74.09 -36.82 64.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.984 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.0 mt -55.09 -59.87 2.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 177.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.52 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 4.6 mt -76.84 -21.6 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -173.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 71' ' ' GLU . 19.3 t -64.43 -33.58 76.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -72.96 -37.32 67.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.175 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.534 HD22 HG12 ' A' ' 55' ' ' ILE . 45.6 tp -59.06 -38.51 79.56 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.434 175.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.41 -43.72 0.87 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.28 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -101.18 107.19 18.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.776 0.322 . . . . 0.0 110.883 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -69.89 124.4 90.57 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.553 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 42.3 Cg_endo -69.05 73.9 1.01 Allowed 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.609 2.206 . . . . 0.0 114.021 -172.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.4 t -104.04 -20.85 13.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.25 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -87.96 8.73 24.98 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.39 0.614 . . . . 0.0 110.174 175.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -119.08 122.83 42.99 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -87.0 -58.9 2.42 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.779 -173.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -92.24 -179.91 5.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 111.434 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.432 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -74.3 -36.59 63.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.679 -176.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -64.33 -38.03 89.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.262 -176.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -58.51 -39.54 80.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.472 ' O ' HG13 ' A' ' 94' ' ' ILE . 77.1 mtt85 -70.4 -40.42 73.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.756 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 87' ' ' ALA . 79.5 mt -63.37 -41.74 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.269 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.67 96.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.219 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -63.91 -38.42 91.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.325 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.478 HG12 HD12 ' A' ' 55' ' ' ILE . 65.8 mt -65.54 -47.52 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 177.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 98' ' ' ILE . 30.4 mt -60.58 -36.37 78.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.953 0.406 . . . . 0.0 111.65 178.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.6 ttpt -63.35 -32.25 73.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.319 -175.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.23 -28.71 47.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 0.0 110.786 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.502 HD12 HD23 ' A' ' 95' ' ' LEU . 63.9 mt -68.23 -40.31 82.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 109.685 175.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.18 -58.12 3.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.23 177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -86.71 74.08 9.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.161 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 102' ' ' GLY . 12.1 pttm -93.22 -67.51 0.85 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.531 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.417 ' H ' ' HG3' ' A' ' 101' ' ' LYS . . . 86.11 -42.82 3.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.803 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -73.84 122.05 21.87 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.9 mp -85.38 110.61 19.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.962 0.411 . . . . 0.0 110.727 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -77.39 130.06 36.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.797 175.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -141.53 23.82 2.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 30.4 m80 -97.25 22.95 7.97 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -65.48 -20.27 66.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.995 -173.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.25 -13.23 17.1 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.375 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.94 26.94 3.28 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.787 0.327 . . . . 0.0 110.465 175.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.808 -0.615 . . . . 0.0 110.167 -178.147 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -91.3 135.11 34.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.601 0.238 . . . . 0.0 111.072 -174.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.8 p -126.22 139.65 53.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.03 136.27 45.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.783 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 5.6 ptpp? -133.25 143.57 49.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.973 0.416 . . . . 0.0 110.775 177.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.691 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -70.76 140.56 51.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.503 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.535 HD13 HG13 ' A' ' 42' ' ' ILE . 43.1 pt -122.82 -43.93 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 67.8 mttm -94.89 94.09 7.83 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.038 0.447 . . . . 0.0 110.462 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.05 -116.04 0.98 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.103 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -179.03 -55.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.9 m -140.57 115.5 9.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.33 176.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -135.87 133.8 38.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 64.5 t30 -102.35 121.61 42.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.091 -176.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.6 t -108.55 106.64 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.214 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.5 mtt 64.48 -85.84 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.993 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -136.19 9.01 4.12 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 121.251 -0.499 . . . . 0.0 111.887 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.462 HD13 HD11 ' A' ' 31' ' ' LEU . 3.8 mp -118.59 112.76 39.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.6 m -88.56 122.94 32.56 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.039 0.447 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -103.36 143.8 32.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.471 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -120.11 146.04 46.33 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.829 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.691 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.53 115.49 2.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.304 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.65 -16.59 60.23 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.693 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -103.28 110.97 31.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.79 0.328 . . . . 0.0 110.208 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.783 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 20.3 m -82.77 136.52 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.253 0.549 . . . . 0.0 111.877 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -114.54 149.41 36.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.436 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -81.68 119.28 23.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 27.7 m -119.44 152.7 53.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.832 0.349 . . . . 0.0 111.574 -173.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.443 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.3 Cg_exo -71.51 177.38 6.84 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.134 2.556 . . . . 0.0 112.087 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.0 -39.51 86.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.469 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -59.37 -52.82 63.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.313 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.538 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 67.3 mt -68.14 -28.91 67.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.393 -175.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 76.8 t80 -60.87 -52.9 63.1 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 177.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -73.47 -31.36 63.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.342 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -61.41 -50.39 73.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.595 ' HB2' HD21 ' A' ' 43' ' ' LEU . 80.1 mt -81.41 -16.9 50.73 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.841 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 56.5 t30 -69.49 -29.54 67.21 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.301 0.572 . . . . 0.0 109.67 175.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.18 -20.85 37.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.568 177.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -94.51 111.35 53.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.433 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.76 29.7 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.262 2.642 . . . . 0.0 114.554 -168.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.513 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.1 p90 -129.21 19.34 5.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.295 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -130.87 136.91 49.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.535 HG13 HD13 ' A' ' 7' ' ' ILE . 4.0 mt -97.8 124.63 50.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.595 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.5 mp -122.07 131.12 53.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.357 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.7 m -125.48 124.97 42.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.451 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.444 ' H ' ' HG3' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -89.76 113.28 24.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.232 0.539 . . . . 0.0 110.319 176.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -102.04 151.15 22.49 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.166 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.8 mp -82.56 166.96 18.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -112.32 -178.18 3.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -65.16 124.1 21.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.924 0.392 . . . . 0.0 111.07 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -85.6 168.64 14.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.486 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.2 119.62 24.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.161 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -82.32 88.91 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 4.2 t0 -53.89 110.65 2.2 Favored Pre-proline 0 N--CA 1.469 0.476 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.412 -171.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.628 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 57.2 Cg_endo -95.74 102.58 0.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.654 2.903 . . . . 0.0 113.334 -176.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.628 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 10.9 tp 163.15 29.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 122.196 0.998 . . . . 0.0 108.569 177.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.525 ' HA ' HD13 ' A' ' 98' ' ' ILE . 27.3 t30 -158.33 89.48 0.98 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.092 -171.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -139.17 164.94 28.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.783 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 60' ' ' SER . 4.6 m -64.74 145.16 56.63 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 172.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -58.88 -37.56 76.86 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 174.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.417 ' H ' HG22 ' A' ' 58' ' ' THR . 16.5 m -63.68 -32.84 74.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.25 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -28.59 62.05 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.319 0.58 . . . . 0.0 110.378 177.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' HB3' HG12 ' A' ' 91' ' ' ILE . 91.4 mt -87.77 -18.82 28.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.259 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -71.06 -43.24 68.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.035 0.445 . . . . 0.0 110.527 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -2.0 90.28 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.922 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.706 ' HG3' ' HG3' ' A' ' 69' ' ' GLU . 49.9 ttm -88.58 131.87 34.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 122.523 0.329 . . . . 0.0 110.34 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.473 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 22.9 m-80 -81.29 175.01 10.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.815 0.34 . . . . 0.0 111.113 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.432 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 19.7 ptmt -67.73 -39.28 84.3 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.07 -53.14 61.43 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.455 -174.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.706 ' HG3' ' HG3' ' A' ' 65' ' ' MET . 3.9 pm0 -65.63 -45.88 81.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.89 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.557 ' O ' HG13 ' A' ' 74' ' ' ILE . 17.4 m-70 -44.53 -53.17 7.31 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.02 -42.63 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.46 -176.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.2 m -61.15 -40.69 94.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.848 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 69' ' ' GLU . 79.8 mt -59.21 -58.66 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.527 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.0 mt -70.8 -24.95 25.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.917 0.389 . . . . 0.0 111.13 -173.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.6 m -68.29 -30.18 69.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.785 0.326 . . . . 0.0 110.233 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -75.17 -26.13 58.84 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.384 175.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 74' ' ' ILE . 50.4 tp -63.02 -32.94 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.495 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.51 5.09 30.1 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.868 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -128.49 99.2 5.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -70.6 129.52 89.94 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.017 -173.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -83.98 43.89 1.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.037 2.492 . . . . 0.0 112.11 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.8 t -70.41 -30.16 66.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.153 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.19 -18.06 35.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 110.588 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -85.47 118.38 24.96 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -111.62 -19.18 12.6 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.86 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 3.5 m-20 -97.45 145.26 26.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.399 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.01 -33.5 75.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.16 -177.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.42 -39.67 77.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.474 ' CD ' ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp0 -60.65 -33.8 73.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.966 0.413 . . . . 0.0 110.274 175.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 71.6 mtt-85 -67.07 -40.6 87.05 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 62' ' ' LEU . 97.0 mt -63.15 -45.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.75 93.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.592 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -70.4 -39.43 74.51 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.635 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -67.79 -34.71 69.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 98' ' ' ILE . 12.8 mt -64.67 -28.62 69.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.887 177.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 96' ' ' LYS . 5.0 tmtm? -77.21 -28.24 53.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.017 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -6.73 58.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.002 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 56' ' ' ASN . 48.0 mm -57.02 -40.27 71.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.674 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.46 -49.86 69.77 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.935 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -61.84 -46.35 89.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.714 -173.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.607 ' HE3' HG21 ' A' ' 55' ' ' ILE . 66.2 mmtt -80.73 -55.99 4.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.705 -175.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 62.66 -105.93 1.13 Allowed Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.893 -176.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -161.75 163.93 29.28 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 mp -86.32 144.13 27.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 179.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 107' ' ' HIS . 11.6 tp10 -70.19 133.65 47.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.941 177.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -104.97 26.44 9.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.26 -175.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.544 ' H ' ' HG3' ' A' ' 105' ' ' GLU . 4.9 t-80 -62.97 105.72 0.72 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.269 0.557 . . . . 0.0 109.832 -178.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -97.32 147.81 23.78 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.578 -171.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -116.85 86.69 2.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.791 -177.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.407 ' HB3' ' H ' ' A' ' 111' ' ' HIS . 0.1 OUTLIER -176.39 -84.4 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -176.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.407 ' H ' ' HB3' ' A' ' 110' ' ' HIS . 55.9 t-80 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.036 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.436 ' O ' ' HA ' ' A' ' 45' ' ' GLN . 26.4 ptt? . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.2 111.36 23.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.425 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.541 ' HB ' ' HB3' ' A' ' 24' ' ' SER . 17.5 p -108.5 131.67 54.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.026 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.79 148.62 28.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.155 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -147.13 132.43 18.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.2 -174.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 6' ' ' LEU . 2.6 mm? -65.31 125.53 25.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.777 175.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.885 HD12 ' HG3' ' A' ' 8' ' ' LYS . 2.7 pp -109.72 -4.63 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.416 0.626 . . . . 0.0 110.36 175.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.885 ' HG3' HD12 ' A' ' 7' ' ' ILE . 61.8 mttm -138.11 127.38 24.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.997 173.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.69 -128.73 8.44 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.311 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -172.68 -48.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.0 m -152.27 128.95 10.81 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -148.92 133.41 17.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.643 0.259 . . . . 0.0 110.741 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 26.2 t-20 -96.26 123.1 39.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.548 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.5 t -110.54 106.49 20.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.005 177.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 66.35 -74.22 0.06 Allowed 'General case' 0 N--CA 1.466 0.364 0 O-C-N 123.941 0.776 . . . . 0.0 111.363 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.01 -0.36 1.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.683 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.2 mp -113.0 121.01 64.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.7 m -92.93 105.54 17.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.788 0.328 . . . . 0.0 110.653 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -93.73 161.77 14.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.167 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -133.8 154.65 50.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.321 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.45 130.73 45.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.771 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.99 -5.54 84.98 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.688 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.9 t -111.38 107.66 23.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.745 0.307 . . . . 0.0 110.638 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.541 ' HB3' ' HB ' ' A' ' 3' ' ' THR . 13.0 m -85.53 111.62 20.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.396 178.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.93 143.66 42.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.138 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -67.83 128.0 34.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.19 157.42 51.03 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.576 -176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.537 ' HD2' HD12 ' A' ' 31' ' ' LEU . 20.5 Cg_exo -67.31 168.82 16.79 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.27 2.647 . . . . 0.0 112.263 175.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -56.48 -48.9 76.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.804 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -58.45 -47.99 82.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.231 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.537 HD12 ' HD2' ' A' ' 28' ' ' PRO . 42.2 mt -69.29 -27.46 65.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.842 -175.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -57.78 -50.47 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 110.605 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.24 -29.56 38.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.859 0.361 . . . . 0.0 110.558 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 65.5 t80 -63.64 -42.15 98.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.5 mt -82.83 -19.78 36.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -70.52 -23.6 62.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.67 0.747 . . . . 0.0 109.316 173.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -92.69 7.85 41.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.474 176.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -108.35 133.21 20.65 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.278 -177.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.12 -11.76 21.27 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.982 2.455 . . . . 0.0 114.832 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.431 ' CB ' ' HB2' ' A' ' 8' ' ' LYS . 6.9 p90 -118.62 23.71 11.32 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.235 -178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -129.23 119.37 23.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.94 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.614 HD12 HG21 ' A' ' 7' ' ' ILE . 14.4 mt -106.39 125.11 62.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 170.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.12 156.67 19.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.0 m -143.22 138.94 30.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.21 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 1' ' ' MET . 3.3 pm0 -110.56 117.76 34.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.216 0.532 . . . . 0.0 110.36 178.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -123.96 161.96 24.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.235 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.4 mp -81.19 159.21 24.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.963 -178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -133.68 -37.66 0.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.067 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -90.41 131.75 36.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.657 -178.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -94.59 152.17 18.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.23 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.592 ' NZ ' ' HA ' ' A' ' 54' ' ' PRO . 19.5 pttp -99.01 26.85 5.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.053 0.454 . . . . 0.0 110.388 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.0 t70 72.56 -69.15 0.2 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.477 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 9.7 t70 -121.68 123.79 27.36 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 121.014 0.435 . . . . 0.0 110.528 -177.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.592 ' HA ' ' NZ ' ' A' ' 51' ' ' LYS . 93.6 Cg_endo -99.55 32.08 0.11 Allowed 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 122.881 2.387 . . . . 0.0 114.209 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.717 HD11 ' HA ' ' A' ' 94' ' ' ILE . 6.5 tp -178.7 78.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.061 0.934 . . . . 0.0 110.79 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.541 ' OD1' HG13 ' A' ' 98' ' ' ILE . 4.9 t30 -170.15 86.39 0.12 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.801 -176.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.54 ' HB2' HD11 ' A' ' 62' ' ' LEU . 94.4 m-85 -141.39 152.01 43.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.748 0.308 . . . . 0.0 110.925 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.685 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 4.4 m -73.61 143.83 46.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.338 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.545 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 7.0 pt-20 -67.36 -38.71 85.22 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.292 177.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 16.2 m -63.16 -27.58 69.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.291 0.567 . . . . 0.0 109.748 174.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.685 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 39.0 tt0 -78.77 -43.52 25.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.226 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 57' ' ' TYR . 96.6 mt -79.26 -18.33 52.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.013 -178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -62.92 -31.42 72.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.787 0.327 . . . . 0.0 110.337 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -102.0 21.84 40.36 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.899 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 25.0 mmt -107.95 146.34 32.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.845 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.774 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 14.4 m120 -71.3 169.64 14.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 43.3 mtmt -60.41 -50.88 71.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.025 176.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.52 -29.11 67.65 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.659 0.6 . . . . 0.0 111.752 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.774 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 4.9 mm-40 -66.23 -46.38 77.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.705 0.764 . . . . 0.0 109.389 177.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.511 ' HE1' ' O ' ' A' ' 62' ' ' LEU . 51.5 m80 -63.09 -38.94 93.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.103 175.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 42.9 mt-10 -68.29 -34.61 76.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.629 -175.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.8 p -70.42 -34.6 72.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.226 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 69' ' ' GLU . 85.5 mt -58.32 -61.73 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.576 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -73.6 -13.52 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.627 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.4 p -79.49 -32.87 42.53 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.366 -0.534 . . . . 0.0 109.749 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.14 -29.45 65.25 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.165 0.507 . . . . 0.0 109.724 173.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.6 tp -73.23 -26.58 61.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.648 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.77 -6.14 67.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.255 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.591 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -73.11 -36.74 66.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.787 0.327 . . . . 0.0 110.199 -179.757 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' ARG . 45.9 m-80 72.38 137.64 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.171 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.488 ' HA ' HD12 ' A' ' 74' ' ' ILE . 6.1 Cg_endo -78.49 -4.18 13.96 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.695 2.263 . . . . 0.0 113.237 -175.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.44 -10.78 57.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.937 0.399 . . . . 0.0 111.464 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -82.72 -15.02 53.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.241 0.544 . . . . 0.0 110.504 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -119.24 146.68 45.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.754 -173.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.529 ' NZ ' ' HB3' ' A' ' 85' ' ' LYS . 5.4 ttpm? -108.76 -65.04 1.17 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 0.0 110.597 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -76.52 157.48 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.914 -176.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.677 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -63.29 -36.78 84.8 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.18 -49.05 67.47 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.281 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 85' ' ' LYS . 40.7 mt-10 -58.29 -37.75 75.65 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.355 0.598 . . . . 0.0 110.493 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -73.45 -34.03 65.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.613 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 87' ' ' ALA . 22.7 mm -63.4 -50.06 80.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 176.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.68 -45.17 81.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.043 -176.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' A' ' 79' ' ' ARG . 41.3 t80 -67.15 -47.61 70.52 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.457 -176.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.717 ' HA ' HD11 ' A' ' 55' ' ' ILE . 61.6 mt -67.32 -38.97 81.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.969 0.414 . . . . 0.0 110.211 -178.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.545 ' HA ' HG22 ' A' ' 98' ' ' ILE . 4.4 mm? -73.23 -16.71 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.459 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -74.35 -43.46 56.52 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 101' ' ' LYS . 2.8 mp0 -76.44 -25.81 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.968 -176.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.566 ' O ' ' HA3' ' A' ' 102' ' ' GLY . 14.1 tt -73.31 -14.7 16.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.529 0.68 . . . . 0.0 109.957 175.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -101.59 -49.33 4.04 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.614 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -66.67 -43.24 85.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.063 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.512 ' HE2' HG23 ' A' ' 55' ' ' ILE . 22.6 ttpp -96.38 -29.92 13.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.371 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.566 ' HA3' ' O ' ' A' ' 98' ' ' ILE . . . -74.21 -1.86 61.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.391 -175.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.13 -21.28 43.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.168 0.509 . . . . 0.0 109.922 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -80.44 93.95 6.1 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.847 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -73.18 -2.4 21.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.387 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -63.03 -31.08 72.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.264 172.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -96.33 77.64 3.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 173.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.81 95.87 9.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.91 -169.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -141.63 20.74 2.18 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.334 171.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -73.32 -57.71 3.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.973 176.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 10.8 p80 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.401 176.506 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttp . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -93.63 126.84 39.02 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.77 131.97 49.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.862 0.363 . . . . 0.0 110.823 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.77 134.26 52.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.429 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -136.65 124.85 23.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.575 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.488 HD23 ' CB ' ' A' ' 19' ' ' PHE . 2.7 mm? -67.57 141.04 56.95 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.28 0.562 . . . . 0.0 111.01 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.556 HG21 HG13 ' A' ' 42' ' ' ILE . 39.1 pt -121.33 -2.4 8.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.473 174.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 95.0 mttt -144.34 149.4 36.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.294 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.39 -28.77 10.1 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.279 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 80.7 tttt 73.78 -37.12 0.36 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.775 0.83 . . . . 0.0 111.504 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.9 m -151.77 123.57 8.0 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -138.88 139.93 38.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 110.387 -174.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -102.9 123.42 46.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.812 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -117.85 102.06 12.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.2 mtt 63.64 -87.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.058 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.17 0.2 6.51 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -105.31 125.33 60.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.8 m -95.65 117.34 30.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.838 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.561 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 95.8 m-85 -107.04 157.54 17.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.768 0.318 . . . . 0.0 110.914 -178.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 20' ' ' ARG . 25.9 mtt180 -124.8 156.3 38.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.835 174.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.441 ' CB ' ' HA ' ' A' ' 10' ' ' LYS . . . -71.88 127.91 34.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.817 0.341 . . . . 0.0 110.599 176.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.9 -4.04 78.1 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.234 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 56.8 t -110.99 108.54 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.778 0.323 . . . . 0.0 110.58 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.8 m -78.34 114.65 17.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.538 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.561 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 42.9 mt-30 -117.36 143.99 45.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 0.0 110.988 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.9 m -72.1 131.29 42.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.861 -175.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 m -136.99 154.98 76.46 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.55 ' HD2' HD12 ' A' ' 31' ' ' LEU . 12.9 Cg_exo -71.05 163.6 38.66 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 111.603 174.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -63.04 -26.78 69.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.465 -176.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -67.67 -36.26 80.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.715 0.293 . . . . 0.0 110.923 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.0 mt -81.1 -31.15 34.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 177.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.539 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 56.7 t80 -60.19 -40.56 90.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.565 174.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -71.16 -43.62 67.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.435 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.23 -40.98 87.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.52 -14.81 51.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.939 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -69.01 -28.8 66.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -86.04 1.76 49.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.087 175.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -121.49 94.49 48.55 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 110.475 -173.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.62 61.89 7.0 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 114.976 -168.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 1.0 OUTLIER -153.22 25.3 0.54 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.261 0.553 . . . . 0.0 110.34 166.571 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -123.98 139.98 53.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.389 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.556 HG13 HG21 ' A' ' 7' ' ' ILE . 11.8 mt -97.2 115.08 35.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 162.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 32.6 mt -99.75 110.14 22.54 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.218 -174.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.4 m -110.59 123.95 50.94 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.71 -175.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -90.03 114.08 25.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -101.23 144.1 30.5 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.526 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.4 mt -118.43 147.27 43.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.898 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -98.47 86.13 3.54 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.456 0.646 . . . . 0.0 110.52 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -98.58 -40.03 8.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.584 175.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.0 154.66 0.14 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.23 176.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -158.2 131.9 7.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.292 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 65.67 91.75 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.527 0.679 . . . . 0.0 109.327 -174.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.484 ' HB2' ' HD3' ' A' ' 54' ' ' PRO . 18.6 m-20 -98.8 -56.35 0.17 Allowed Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.076 -170.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 53' ' ' ASP . 80.5 Cg_endo -74.9 41.88 0.78 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.403 2.069 . . . . 0.0 114.246 -170.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.546 HG12 ' HG2' ' A' ' 97' ' ' GLN . 10.5 tp 179.87 29.98 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.017 0.913 . . . . 0.0 109.842 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -150.63 91.47 1.74 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.905 -173.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -142.74 153.47 43.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.672 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.585 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.6 m -62.44 143.1 57.48 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.699 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.86 -34.69 73.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -70.94 -28.78 64.74 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.615 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.585 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 14.2 mm-40 -71.98 -34.11 68.68 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.02 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.495 HD23 ' SD ' ' A' ' 65' ' ' MET . 95.8 mt -81.85 -20.4 39.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.253 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 32.0 mmtp -64.96 -28.13 69.31 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.076 0.465 . . . . 0.0 109.814 172.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.49 23.9 33.87 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.293 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.495 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -122.17 147.56 46.01 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.23 -176.37 4.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.832 0.348 . . . . 0.0 110.808 -178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 58.5 tttm -52.16 -44.14 64.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.195 -176.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.23 89.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.803 -174.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.7 OUTLIER -61.84 -50.02 73.96 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.702 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.507 ' O ' HG13 ' A' ' 74' ' ' ILE . 58.5 m80 -50.56 -46.12 57.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.186 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.476 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 43.1 mt-10 -64.67 -51.27 63.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.74 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.7 t -57.16 -50.11 73.85 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.301 0.376 . . . . 0.0 111.436 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.1 mt -52.84 -61.07 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.638 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.734 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 2.1 mt -77.36 -18.87 14.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.509 -170.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.0 m -69.14 -31.03 69.42 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -72.55 -32.45 66.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.306 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.466 HD22 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -66.39 -38.82 88.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.39 173.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.1 -69.72 0.46 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.083 -0.58 . . . . 0.0 111.816 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.453 ' O ' HG22 ' A' ' 74' ' ' ILE . 39.0 ttm180 -80.27 102.79 9.71 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.429 ' HB2' ' HD2' ' A' ' 81' ' ' PRO . 30.7 p-10 -71.22 155.42 93.07 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.178 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.734 ' HD3' ' HB ' ' A' ' 74' ' ' ILE . 60.0 Cg_endo -73.67 36.76 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.105 2.537 . . . . 0.0 113.91 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.4 t -79.75 -29.86 40.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -71.56 -38.98 70.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.809 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -88.4 108.68 19.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.833 -178.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -71.81 -63.08 1.2 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.228 -172.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -72.11 150.55 43.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.937 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.44 -37.21 80.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.559 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -60.22 -39.21 85.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.907 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -62.55 -38.66 90.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.304 0.573 . . . . 0.0 110.406 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 34.4 mtt180 -68.76 -38.46 80.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.951 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.24 -45.4 93.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.143 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.5 90.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.354 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.505 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.5 t80 -66.8 -36.77 83.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.823 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.1 mt -71.92 -46.09 61.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.389 . . . . 0.0 110.365 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 59' ' ' GLU . 3.7 mm? -65.14 -45.55 84.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.745 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -79.4 -5.4 54.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.369 -0.533 . . . . 0.0 110.472 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.546 ' HG2' HG12 ' A' ' 55' ' ' ILE . 32.8 tp60 -70.94 -31.9 68.63 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 41.6 mt -65.9 -26.76 39.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.635 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -78.2 -41.24 35.13 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.954 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -82.26 -42.65 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.594 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -88.0 -13.68 41.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.029 0.443 . . . . 0.0 110.68 -174.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.51 -104.09 1.23 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.807 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.02 96.3 6.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.602 0.239 . . . . 0.0 110.357 177.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 39.3 tp -77.8 -72.03 0.39 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 174.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 63.49 -178.46 0.15 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.752 175.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -116.98 -14.25 10.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.766 -175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.6 t60 -79.8 80.97 6.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.778 0.323 . . . . 0.0 110.748 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -179.72 66.01 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.102 173.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -128.53 14.57 6.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.661 0.744 . . . . 0.0 109.447 176.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -177.48 -36.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.971 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.981 175.677 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -129.01 104.2 7.44 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 67.9 p -108.69 143.6 37.58 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.359 -175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.39 138.69 52.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.544 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -141.28 134.74 29.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.584 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 21' ' ' ALA . 3.8 mm? -61.64 123.91 19.22 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.814 0.34 . . . . 0.0 110.646 176.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.542 HG13 ' HD2' ' A' ' 8' ' ' LYS . 13.5 pt -100.65 -23.01 4.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.014 173.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.542 ' HD2' HG13 ' A' ' 7' ' ' ILE . 2.0 mptp? -132.6 122.31 24.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.099 171.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.82 -137.44 8.68 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.218 -0.991 . . . . 0.0 112.888 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.77 ' HG3' ' H ' ' A' ' 11' ' ' THR . 49.6 pttt -168.01 -68.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.77 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.6 p -132.14 118.38 19.53 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -129.77 111.74 12.93 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 45.3 t-20 -95.92 120.03 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.225 -177.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.481 HG21 HD21 ' A' ' 35' ' ' LEU . 50.5 t -119.13 104.49 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 0.0 110.682 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.2 mtt 62.95 20.14 12.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.124 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.11 -30.19 5.73 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.379 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.29 116.34 30.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.8 m -96.58 108.81 21.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 -177.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.406 ' HB2' ' CD2' ' A' ' 6' ' ' LEU . 37.5 m-85 -90.08 144.6 25.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.537 ' HG3' HG22 ' A' ' 11' ' ' THR . 10.1 mpt_? -117.06 149.13 40.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.561 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HA ' ' HB2' ' A' ' 6' ' ' LEU . . . -63.31 109.82 1.7 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.588 176.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.65 -1.78 39.27 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.193 -178.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.7 t -117.47 125.54 74.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.76 0.314 . . . . 0.0 110.516 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 m -100.04 123.49 44.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.518 178.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -118.79 150.69 39.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.71 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -92.78 126.65 37.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.213 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.9 m -124.46 157.42 65.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.195 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.57 ' HD2' HD12 ' A' ' 31' ' ' LEU . 38.3 Cg_exo -62.21 156.91 47.72 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.936 2.424 . . . . 0.0 110.974 171.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -68.08 -15.85 63.77 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -172.772 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -71.65 -43.03 66.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.423 . . . . 0.0 110.026 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.57 HD12 ' HD2' ' A' ' 28' ' ' PRO . 38.0 mt -73.74 -33.69 64.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.902 175.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.591 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 84.4 t80 -53.65 -53.95 44.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.708 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 37' ' ' GLU . 4.2 mm-40 -65.94 -36.7 84.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.581 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -62.45 -45.84 91.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 110.276 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.481 HD21 HG21 ' A' ' 14' ' ' VAL . 95.5 mt -74.08 -25.9 60.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.037 0.446 . . . . 0.0 110.602 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.02 -26.31 68.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.093 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 41.8 mt-10 -77.82 -11.29 59.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.319 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 35.4 m-80 -102.38 113.81 65.7 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.93 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 19.1 Cg_exo -66.85 -7.39 18.3 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 123.184 2.589 . . . . 0.0 114.546 -173.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -101.62 17.0 23.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.416 -0.513 . . . . 0.0 111.917 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -119.33 131.68 55.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.457 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' HG21 ' A' ' 7' ' ' ILE . 14.0 tt -97.19 117.39 41.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.685 0.755 . . . . 0.0 108.998 166.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.47 ' HA ' ' O ' ' A' ' 3' ' ' THR . 4.9 mp -107.07 115.59 30.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.828 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.3 m -104.68 124.74 49.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.368 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -101.92 104.46 15.17 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.43 114.2 27.99 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.033 0.444 . . . . 0.0 110.311 178.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.27 138.62 57.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.97 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -63.33 -31.05 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -131.26 123.46 28.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.092 172.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -116.53 166.04 12.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.267 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -102.33 12.51 36.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.784 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 20.7 t0 57.51 90.89 0.04 OUTLIER 'General case' 0 C--O 1.233 0.227 0 O-C-N 123.746 0.654 . . . . 0.0 110.814 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -66.97 113.14 11.92 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.048 -175.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.469 ' O ' HG22 ' A' ' 55' ' ' ILE . 96.1 Cg_endo -80.19 161.82 23.08 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.866 2.377 . . . . 0.0 112.387 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.702 HG12 HD22 ' A' ' 77' ' ' LEU . 7.0 tp 52.45 24.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 124.142 0.977 . . . . 0.0 111.766 178.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.536 ' OD1' HG12 ' A' ' 98' ' ' ILE . 7.9 t30 -153.1 83.51 1.2 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.128 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.24 152.45 50.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.113 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.736 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 24.3 m -57.23 138.27 54.9 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.375 0.422 . . . . 0.0 110.247 172.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 1.3 pt-20 -58.78 -30.43 67.55 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.712 ' H ' HG22 ' A' ' 58' ' ' THR . 15.1 m -69.2 -26.95 65.08 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.242 175.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.736 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 8.5 mm-40 -79.19 -44.49 21.78 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-O 121.061 0.458 . . . . 0.0 110.19 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.405 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 57.9 mt -70.77 -20.63 62.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.455 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -65.12 -36.02 82.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.887 -177.195 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.08 42.16 1.96 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.719 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.402 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.6 mtt -117.53 166.37 12.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.032 0.444 . . . . 0.0 110.996 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.568 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 36.3 m-80 -83.51 162.36 20.93 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.293 174.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -67.21 -38.49 85.39 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.421 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.38 73.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.568 ' HG3' ' HB2' ' A' ' 66' ' ' ASN . 41.7 mt-10 -63.99 -49.89 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.466 ' O ' HG13 ' A' ' 74' ' ' ILE . 55.9 m80 -54.51 -44.46 72.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.022 173.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.3 mt-10 -57.81 -44.39 86.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.736 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.6 m -64.94 -45.56 85.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.945 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.0 mt -56.94 -59.71 2.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.347 0.594 . . . . 0.0 111.466 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 70' ' ' HIS . 5.2 mt -73.04 -21.49 19.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.036 -172.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.0 t -66.37 -36.46 82.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 175.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -69.51 -31.94 70.48 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.001 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.702 HD22 HG12 ' A' ' 55' ' ' ILE . 31.6 tp -63.1 -38.03 89.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.376 173.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.38 28.23 2.86 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.948 -177.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.515 ' HD2' ' OH ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -150.49 102.64 3.06 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 177.819 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -75.0 116.64 56.03 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.227 0.537 . . . . 0.0 110.269 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.52 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 96.0 Cg_endo -79.61 29.52 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 123.067 2.512 . . . . 0.0 112.738 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.96 -17.57 64.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.04 -27.25 30.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -82.43 109.05 16.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.733 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -71.73 -40.29 69.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.809 -174.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.538 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 19.2 m-80 -91.88 166.99 12.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.95 0.405 . . . . 0.0 110.148 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.527 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -85.77 -22.7 27.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.759 -178.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -63.0 -49.07 76.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.202 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.538 ' OE1' ' HB2' ' A' ' 86' ' ' ASN . 2.0 mp0 -58.57 -35.33 72.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.096 0.474 . . . . 0.0 110.615 177.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.0 mtt180 -66.14 -38.61 88.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.042 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 87' ' ' ALA . 77.0 mt -66.85 -45.06 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.008 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.23 99.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.427 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.515 ' OH ' ' HD2' ' A' ' 79' ' ' ARG . 64.3 t80 -65.95 -36.81 84.36 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.899 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' ARG . 77.5 mt -66.88 -36.4 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.147 177.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 98' ' ' ILE . 85.4 mt -62.57 -28.07 69.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.749 174.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 93' ' ' TYR . 37.7 ttmt -63.15 -30.41 71.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.548 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 22.0 mp0 -76.67 -31.76 57.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.478 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.536 HG12 ' OD1' ' A' ' 56' ' ' ASN . 45.0 mt -66.2 -34.66 71.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.633 0.73 . . . . 0.0 109.805 174.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -63.83 -29.47 70.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.407 177.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -86.43 -54.21 4.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.792 178.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -102.01 99.87 10.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.456 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 147.88 -61.23 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -162.54 91.52 0.76 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.912 0.387 . . . . 0.0 110.769 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 pp -88.71 -26.9 21.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.56 0.695 . . . . 0.0 109.524 173.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -102.73 100.01 10.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -63.46 121.21 13.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 0.0 111.541 -172.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -93.86 158.83 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 11.8 p80 -92.2 68.54 5.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.994 0.902 . . . . 0.0 109.456 173.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -115.61 -48.82 2.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.383 -1.28 . . . . 0.0 109.642 -176.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -90.8 -29.09 17.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.581 174.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.352 -0.833 . . . . 0.0 109.735 -179.749 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.578 ' HB3' ' HB2' ' A' ' 46' ' ' GLU . 65.6 mtt . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 121.163 0.506 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.549 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 63.8 m-85 -123.52 114.26 19.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.242 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.9 p -111.09 122.88 49.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.01 0.433 . . . . 0.0 110.954 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.21 127.64 54.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.351 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -121.22 118.33 29.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.834 0.35 . . . . 0.0 110.724 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -66.92 126.84 30.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.557 HD13 HG13 ' A' ' 42' ' ' ILE . 26.4 pt -116.99 -33.06 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.862 0.363 . . . . 0.0 111.959 -175.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 61.2 tttp -111.97 102.52 10.74 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -176.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.86 -119.0 1.47 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.411 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -176.5 -65.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -173.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 m -137.78 123.21 19.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.7 177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -127.64 146.82 50.42 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -175.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -119.44 117.26 27.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.606 0.241 . . . . 0.0 110.544 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -115.23 101.39 12.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.6 mtt 62.73 -86.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.31 178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.67 9.15 6.13 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.272 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.405 HD12 ' N ' ' A' ' 17' ' ' ILE . 4.4 mp -118.96 126.45 75.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.1 m -99.11 128.22 45.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.4 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -109.86 139.13 45.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.47 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.5 mtm-85 -116.49 142.43 46.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.17 117.3 3.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 111.623 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.87 0.34 55.12 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.765 -0.731 . . . . 0.0 113.045 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -109.55 116.44 52.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 111.005 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.6 m -83.2 106.75 15.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.728 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -109.84 139.42 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.525 -176.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -71.99 120.27 17.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.003 0.43 . . . . 0.0 110.533 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.8 m -112.98 158.32 38.16 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.339 -175.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 31' ' ' LEU . 34.0 Cg_exo -62.37 150.68 86.36 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.624 2.216 . . . . 0.0 111.293 172.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -59.12 -29.99 67.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.425 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.84 -44.6 85.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 0.0 110.693 176.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 34' ' ' TYR . 62.6 mt -76.07 -20.76 57.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.297 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.549 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 73.8 t80 -60.8 -47.86 84.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.895 0.379 . . . . 0.0 110.06 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -73.19 -35.36 66.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.058 0.456 . . . . 0.0 110.024 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 83.3 t80 -59.92 -29.83 68.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.746 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.4 mt -94.66 -16.26 23.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.003 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.32 -29.79 67.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.637 0.732 . . . . 0.0 109.821 177.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -90.6 7.46 39.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.253 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -115.18 106.64 50.92 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.611 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -76.58 40.67 0.8 Allowed 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.561 2.84 . . . . 0.0 115.337 -165.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.461 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 2.1 p90 -149.01 25.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 173.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.466 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 61.6 m-85 -127.06 138.61 53.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.226 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.557 HG13 HD13 ' A' ' 7' ' ' ILE . 46.8 mt -96.67 113.29 30.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.466 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 18.4 mt -100.32 107.79 19.67 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.763 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 p -102.87 115.06 29.86 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.652 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -90.29 135.92 33.38 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.578 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 37.3 mt-10 -101.42 108.86 20.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.205 0.526 . . . . 0.0 109.739 -175.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 75.0 mt -107.29 96.26 6.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.192 -174.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -97.24 73.53 2.48 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.76 -65.29 1.03 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.073 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -142.67 131.03 22.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.937 ' HD3' ' HB2' ' A' ' 52' ' ' ASP . 13.9 tmtt? -163.49 135.07 4.87 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.929 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.937 ' HB2' ' HD3' ' A' ' 51' ' ' LYS . 2.6 t70 78.44 136.26 0.06 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 124.176 0.922 . . . . 0.0 112.321 171.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -103.74 105.19 46.6 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 173.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.75 38.22 0.45 Allowed 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 123.403 2.735 . . . . 0.0 114.033 -171.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.662 HG12 HD13 ' A' ' 77' ' ' LEU . 10.2 tp -174.81 30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.899 0.856 . . . . 0.0 109.314 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -159.0 94.72 1.23 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.996 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -138.08 157.0 47.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.839 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.915 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.5 m -63.77 134.09 54.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 173.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 13.0 pt-20 -59.42 -33.45 71.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 p -69.22 -30.0 68.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.24 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.915 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 59.3 mm-40 -73.17 -37.25 66.61 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.635 176.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 97.6 mt -77.48 -15.34 59.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.581 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 27.4 mmtp -70.79 -37.24 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.753 0.311 . . . . 0.0 111.06 176.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.4 39.3 3.0 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.555 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 64.4 mtt -137.21 172.82 12.43 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.78 -157.51 0.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -68.62 -42.22 78.39 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.588 -175.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.62 62.78 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.8 mp0 -52.35 -55.88 18.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.971 0.415 . . . . 0.0 110.392 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.608 ' HE1' HG12 ' A' ' 91' ' ' ILE . 28.0 m-70 -58.96 -44.6 91.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.831 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 63.5 mt-10 -63.63 -41.46 98.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.772 -0.195 . . . . 0.0 111.108 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.1 p -65.34 -34.62 78.75 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.521 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 70' ' ' HIS . 96.6 mt -58.81 -57.59 10.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.962 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 70' ' ' HIS . 1.3 mt -72.55 -16.1 17.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.862 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 66.7 m -67.9 -36.51 80.33 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -66.44 -34.52 78.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.007 173.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.662 HD13 HG12 ' A' ' 55' ' ' ILE . 46.3 tp -63.59 -38.37 90.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.008 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 104.06 23.8 7.96 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.083 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.468 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 0.1 OUTLIER -131.66 126.23 34.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.727 0.298 . . . . 0.0 110.269 -178.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -73.89 136.51 76.77 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.888 178.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.481 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 5.0 Cg_exo -80.23 49.46 3.21 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.082 2.521 . . . . 0.0 111.329 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -49.75 -54.29 19.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.153 -170.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -106.27 24.73 12.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.338 0.589 . . . . 0.0 110.964 -174.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -107.61 120.27 41.76 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.466 ' HG2' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -115.56 -32.86 5.41 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.918 -175.02 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.58 169.59 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.548 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -72.98 -41.26 64.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.671 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.19 -44.8 88.23 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.632 0.582 . . . . 0.0 111.628 -177.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' A' ' 85' ' ' LYS . 33.3 mt-10 -58.09 -38.78 77.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 110.55 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.553 ' HD3' ' HB2' ' A' ' 70' ' ' HIS . 73.0 mtt85 -72.81 -32.04 65.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.711 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.608 HG12 ' HE1' ' A' ' 70' ' ' HIS . 75.8 mt -67.49 -47.15 81.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.15 -44.77 75.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.189 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.468 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 37.0 t80 -65.05 -40.51 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.92 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.489 ' O ' HG13 ' A' ' 98' ' ' ILE . 86.9 mt -67.52 -44.31 86.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.425 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.487 HD13 HD12 ' A' ' 98' ' ' ILE . 3.7 mm? -62.61 -41.37 98.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.292 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -65.32 -28.0 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 110.991 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -19.4 46.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.915 0.388 . . . . 0.0 110.39 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 94' ' ' ILE . 75.9 mt -74.27 -42.2 50.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 172.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.8 -48.74 70.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.28 176.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -89.77 32.45 0.89 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.798 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -66.53 -34.91 78.97 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 97.26 -107.6 3.52 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.193 172.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 68.03 84.02 0.16 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.505 0.722 . . . . 0.0 112.201 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -111.3 122.89 49.03 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.14 120.36 23.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.648 0.737 . . . . 0.0 111.349 -176.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -90.98 16.8 8.84 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.364 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -87.84 -26.41 22.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.595 -173.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.7 p-80 -82.56 114.26 20.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.375 0.607 . . . . 0.0 110.378 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -90.38 -16.44 29.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.899 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -87.92 138.04 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.295 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.8 p80 . . . . . 0 C--O 1.244 0.764 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.421 175.659 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.303 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -95.87 108.09 20.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -116.28 134.86 54.44 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -170.037 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.65 118.66 28.66 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 174.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 38.9 ttpt -119.11 126.4 51.54 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.835 0.35 . . . . 0.0 110.332 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.645 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -66.02 125.33 25.12 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.401 HG13 ' HG3' ' A' ' 8' ' ' LYS . 29.3 pt -111.9 -30.91 2.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.267 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 7' ' ' ILE . 64.2 mttp -127.89 111.53 13.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.781 0.324 . . . . 0.0 110.726 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.47 -13.29 3.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.658 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 61.5 mttp 71.39 -51.02 0.69 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.496 0.719 . . . . 0.0 111.922 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -150.35 129.45 12.69 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.741 0.305 . . . . 0.0 110.349 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -156.77 129.71 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 10.5 p30 -111.19 146.15 37.4 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.913 -177.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 HD21 ' A' ' 35' ' ' LEU . 44.6 t -127.93 99.25 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.274 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 61.9 mtm 57.74 49.55 12.1 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.855 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.49 -35.58 4.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.603 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.491 HD13 HD11 ' A' ' 31' ' ' LEU . 4.0 mp -80.24 108.76 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 29.2 m -91.44 126.77 36.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.017 -178.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 71.7 m-85 -108.03 146.04 33.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.81 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -133.87 154.88 50.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.688 0.28 . . . . 0.0 110.972 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.645 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -60.76 105.34 0.44 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.081 178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.74 11.17 47.89 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.688 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.67 108.21 24.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.887 0.375 . . . . 0.0 110.632 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.414 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 15.2 m -74.95 122.13 22.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.592 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -121.51 129.13 52.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.504 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.5 p -74.42 129.91 38.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.732 0.301 . . . . 0.0 110.351 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 29.5 m -120.73 153.4 56.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.468 -174.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.542 ' HD2' HD12 ' A' ' 31' ' ' LEU . 19.5 Cg_exo -67.12 164.99 28.03 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.714 2.276 . . . . 0.0 111.167 171.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.41 -29.99 70.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.858 0.361 . . . . 0.0 110.938 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -64.72 -50.16 68.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.713 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.542 HD12 ' HD2' ' A' ' 28' ' ' PRO . 45.2 mt -71.72 -29.41 64.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.503 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -55.44 -51.36 67.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.523 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 44.8 mt-10 -75.42 -31.25 60.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.98 0.419 . . . . 0.0 110.776 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -61.46 -33.36 73.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.303 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.536 HD22 ' CE1' ' A' ' 41' ' ' PHE . 93.2 mt -98.69 -12.61 20.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.982 177.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.559 ' HA ' HD11 ' A' ' 43' ' ' LEU . 5.8 t30 -61.22 -36.16 79.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.565 0.698 . . . . 0.0 109.882 173.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 37' ' ' GLU . 7.9 pt-20 -87.12 13.41 9.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.266 176.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 6.6 m-20 -116.58 122.96 31.07 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.792 0.329 . . . . 0.0 110.352 177.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 96.3 Cg_endo -88.64 22.42 0.86 Allowed 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.992 2.461 . . . . 0.0 114.101 -174.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -127.58 21.49 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.188 0.518 . . . . 0.0 111.669 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CE1' HD22 ' A' ' 35' ' ' LEU . 73.9 m-85 -128.49 145.49 51.09 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.492 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.9 tt -97.33 124.32 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 171.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 36' ' ' ASN . 12.5 mt -100.84 108.37 20.15 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.141 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 3' ' ' THR . 20.8 m -101.11 106.84 18.14 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.818 -174.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -107.97 110.32 22.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.224 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -101.64 104.87 15.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.825 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 56.3 tp -120.01 95.89 4.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.965 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.06 92.3 3.67 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.3 0.571 . . . . 0.0 110.181 177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -85.1 93.83 8.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.208 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -113.94 -6.84 13.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.95 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -128.73 94.53 3.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.19 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -141.99 1.73 1.48 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -89.69 126.85 56.5 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.347 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.442 ' O ' HG22 ' A' ' 55' ' ' ILE . 20.0 Cg_exo -66.58 -177.1 0.82 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.858 2.372 . . . . 0.0 111.754 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.786 HG12 HD22 ' A' ' 77' ' ' LEU . 10.8 tp 49.02 25.61 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-O 121.915 0.864 . . . . 0.0 111.458 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -141.62 96.46 2.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.819 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.453 ' HB2' HD11 ' A' ' 62' ' ' LEU . 83.8 m-85 -140.6 161.91 36.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.709 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.644 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 1.1 m -61.88 133.58 55.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 60' ' ' SER . 0.6 OUTLIER -66.5 -32.95 74.63 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.969 -0.693 . . . . 0.0 109.706 -179.115 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.492 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 10.8 m -69.73 -24.83 63.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.223 0.535 . . . . 0.0 109.819 174.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.644 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 59.4 tt0 -81.66 -35.52 29.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.849 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 57' ' ' TYR . 96.3 mt -83.06 -6.32 59.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.718 175.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD2' HD13 ' A' ' 91' ' ' ILE . 15.5 tptt -66.25 -27.1 67.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.626 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.21 -119.01 4.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 173.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.459 ' HB3' ' H ' ' A' ' 66' ' ' ASN . 24.2 mmt 59.74 -158.17 0.32 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.423 0.63 . . . . 0.0 111.927 174.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.762 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 42.9 t-20 -123.64 158.66 31.03 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.96 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -67.27 -36.36 81.4 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 71' ' ' GLU . . . -61.85 -32.77 73.14 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.131 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.762 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 12.5 mm-40 -62.66 -56.67 15.62 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.671 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.8 m80 -51.45 -40.61 59.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.963 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 45.1 mm-40 -51.84 -64.99 0.64 Allowed 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.302 0.376 . . . . 0.0 110.549 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.8 m -56.91 -44.47 82.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.216 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.2 mt -53.28 -57.22 5.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.648 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.671 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.2 mt -82.05 -20.96 10.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.753 -172.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.51 -33.38 74.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -73.38 -27.76 61.65 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.786 HD22 HG12 ' A' ' 55' ' ' ILE . 56.7 tp -65.89 -29.75 70.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.97 0.414 . . . . 0.0 110.173 172.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.84 9.38 26.56 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.466 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -133.47 97.82 4.05 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.461 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 14.5 m120 -68.42 131.8 91.59 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.698 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 80' ' ' ASN . 57.1 Cg_endo -88.92 65.39 2.75 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.924 2.416 . . . . 0.0 112.379 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.1 t -86.36 -31.7 21.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.471 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -90.05 -25.01 21.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.937 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -82.32 108.65 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -92.69 -61.92 1.5 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.52 -168.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -72.81 163.72 27.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.04 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -63.64 -45.73 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.52 -174.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.526 ' HA ' HD12 ' A' ' 91' ' ' ILE . 10.3 t70 -65.97 -32.27 73.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.077 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.37 -44.0 96.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.544 0.688 . . . . 0.0 110.074 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -68.57 -34.83 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.24 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 88' ' ' ASP . 86.3 mt -65.8 -41.51 90.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.12 176.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.34 83.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.71 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -63.33 -44.76 93.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.623 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.485 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.0 mt -61.33 -45.56 98.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.206 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -47.95 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.562 -177.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.0 mttp -67.13 -20.87 65.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.476 HE21 ' HB3' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -80.16 -40.49 27.2 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.723 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 94' ' ' ILE . 83.4 mt -63.74 -35.32 72.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.456 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -60.15 -33.64 72.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.199 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -64.44 -34.29 77.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.32 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -91.57 18.88 6.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.357 178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.1 -45.79 47.77 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.23 -0.51 . . . . 0.0 112.751 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -113.89 141.48 47.3 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.2 mt 53.17 64.09 1.99 Allowed 'General case' 0 C--O 1.235 0.333 0 O-C-N 123.7 0.625 . . . . 0.0 110.473 -176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 1.0 OUTLIER -80.34 28.54 0.31 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.21 -176.606 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.4 p80 41.88 88.82 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.136 0.974 . . . . 0.0 113.028 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -64.22 -26.59 68.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.042 177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -120.21 105.16 10.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.727 174.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -83.79 4.37 29.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.568 -177.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.9 t-160 71.78 100.22 0.07 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.182 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.6 t60 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.632 -177.625 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.8 mtp . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.57 129.41 50.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.641 ' OG1' ' HB ' ' A' ' 44' ' ' THR . 73.9 p -131.59 155.48 47.44 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.686 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -126.84 137.8 53.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.224 177.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HB2' ' OG ' ' A' ' 24' ' ' SER . 5.8 ttpm? -120.73 116.97 26.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.104 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.602 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -67.99 124.28 22.95 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.582 HG13 ' N ' ' A' ' 8' ' ' LYS . 18.9 pt -117.61 -36.67 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.909 0.385 . . . . 0.0 111.695 -177.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.582 ' N ' HG13 ' A' ' 7' ' ' ILE . 44.9 tttm -92.06 30.56 1.4 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.747 -167.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.1 -126.7 0.85 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.62 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -160.13 -44.45 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.7 m -152.99 125.01 7.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.989 174.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -140.01 117.55 11.49 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.2 t-20 -91.22 115.87 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.3 t -106.38 97.29 5.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.726 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 62.8 mtt 59.39 22.65 11.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.931 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 121.6 -33.75 4.18 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.578 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.9 mm -78.32 108.79 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.3 m -91.06 101.22 13.97 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.702 0.286 . . . . 0.0 110.759 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 98.4 m-85 -86.06 144.37 27.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.587 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -124.97 143.26 50.98 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -51.71 118.27 3.26 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.67 4.03 59.33 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.768 -0.651 . . . . 0.0 113.224 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.5 t -117.75 112.1 37.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 117.024 0.412 . . . . 0.0 111.523 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 71.5 m -74.45 116.47 15.16 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.896 171.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.5 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 25.6 mt-30 -116.3 146.78 42.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.498 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.533 ' HA ' HG22 ' A' ' 3' ' ' THR . 13.0 p -67.51 131.81 46.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.127 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 35.6 m -134.7 144.83 52.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.922 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.557 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.7 Cg_exo -66.96 161.77 41.0 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.627 2.218 . . . . 0.0 110.883 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -59.02 -31.53 68.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.613 0.245 . . . . 0.0 111.469 -176.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.51 -48.49 79.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.862 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.557 HD12 ' HD2' ' A' ' 28' ' ' PRO . 68.9 mt -73.4 -29.01 62.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.667 0.27 . . . . 0.0 110.537 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -55.6 -48.95 74.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.962 174.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -71.56 -34.87 70.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.309 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 66.8 t80 -64.94 -40.84 95.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.595 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.498 HD22 ' CE1' ' A' ' 41' ' ' PHE . 73.6 mt -81.93 -20.13 39.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.741 0.305 . . . . 0.0 110.629 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -66.32 -26.05 67.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.679 0.752 . . . . 0.0 109.051 169.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB3' ' O ' ' A' ' 34' ' ' TYR . 13.7 tp10 -79.4 -15.42 57.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.929 176.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 40' ' ' TYR . 40.4 m-80 -115.14 113.18 43.85 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.532 -174.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 2.8 Cg_exo -75.32 41.34 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.016 2.477 . . . . 0.0 114.105 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 38' ' ' ASN . 9.1 m-85 -111.75 -6.26 14.34 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.926 0.393 . . . . 0.0 110.001 176.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.498 ' CE1' HD22 ' A' ' 35' ' ' LEU . 78.7 m-85 -124.41 141.79 51.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.783 -169.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.553 HG13 HD13 ' A' ' 7' ' ' ILE . 68.9 mt -110.57 111.25 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 164.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 6.3 mp -82.91 148.52 27.63 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 120.955 0.407 . . . . 0.0 111.193 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.641 ' HB ' ' OG1' ' A' ' 3' ' ' THR . 17.7 m -116.53 107.33 14.62 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.675 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -94.38 112.61 24.4 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -104.81 115.64 30.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.151 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.3 tt -91.12 114.03 26.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -79.48 102.22 8.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.372 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -76.54 110.26 10.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.077 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -112.19 79.56 1.23 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -102.87 -11.79 18.01 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.172 0.511 . . . . 0.0 110.167 -175.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -73.23 117.69 15.28 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.757 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 56.37 84.26 0.21 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.409 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.487 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 2.7 Cg_exo -76.74 96.36 1.09 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.362 2.708 . . . . 0.0 112.606 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.459 HG12 HD13 ' A' ' 77' ' ' LEU . 10.4 tp -171.33 21.2 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 122.46 1.124 . . . . 0.0 108.998 174.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -153.29 100.17 2.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.901 -175.071 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.425 ' HB2' HD11 ' A' ' 62' ' ' LEU . 90.9 m-85 -142.66 177.83 8.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.316 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.642 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -76.76 133.37 39.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.928 177.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 63' ' ' LYS . 4.2 pt-20 -66.97 -33.01 74.65 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.46 -178.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 11.5 p -74.28 -22.71 59.17 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.642 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 53.9 tt0 -80.19 -40.58 26.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.452 176.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 81.0 mt -75.85 -9.98 59.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.746 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' A' ' 59' ' ' GLU . 7.6 tppt? -66.39 -19.84 65.91 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.13 -113.23 2.11 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.52 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.7 mtt 62.13 -175.4 0.14 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.53 0.681 . . . . 0.0 111.562 -177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.682 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 46.4 t30 -95.49 151.41 19.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.279 174.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 51.8 mtmt -54.1 -48.24 70.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.805 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.4 -30.39 64.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.088 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.682 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 7.0 mm-40 -63.67 -52.02 62.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 73' ' ' ILE . 77.7 m-70 -55.79 -44.21 77.57 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.49 -43.45 97.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.611 -177.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -64.19 -40.61 96.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.757 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.4 mt -51.99 -62.15 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.13 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.4 OUTLIER -76.45 -16.93 15.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.935 -174.035 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.0 t -66.34 -35.2 79.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -32.02 60.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.353 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.459 HD13 HG12 ' A' ' 55' ' ' ILE . 47.1 tp -63.51 -36.21 83.03 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.151 0.5 . . . . 0.0 110.404 174.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.9 5.3 33.41 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.112 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.13 119.5 39.48 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -63.07 122.57 75.99 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.053 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.72 -3.33 11.76 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.189 2.592 . . . . 0.0 111.926 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.0 m -68.34 -12.2 60.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.965 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.97 -34.37 71.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.188 0.518 . . . . 0.0 110.559 175.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.628 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . 57.8 m-85 -100.23 122.75 43.53 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.95 -171.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -82.33 -40.19 21.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.304 -178.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.87 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 94.6 m-20 -96.38 162.16 13.61 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.047 0.451 . . . . 0.0 111.597 -176.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.453 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -70.62 -36.08 73.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.54 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -63.92 -36.86 85.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.428 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.87 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 21.1 mm-40 -59.45 -40.37 86.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.368 0.604 . . . . 0.0 109.75 176.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.9 mtt85 -63.81 -49.14 74.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.619 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 87' ' ' ALA . 61.8 mt -60.08 -42.85 91.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.171 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.19 77.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.379 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -78.05 -41.15 36.42 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.519 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.551 ' O ' HG13 ' A' ' 98' ' ' ILE . 70.1 mt -62.49 -44.67 99.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.55 ' HA ' HD12 ' A' ' 98' ' ' ILE . 14.9 mt -62.23 -29.23 70.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.625 176.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.471 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 3.9 ttmp? -61.84 -42.37 98.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.775 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -81.1 -20.12 42.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 94' ' ' ILE . 96.6 mt -71.75 -44.27 68.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.127 0.489 . . . . 0.0 110.09 176.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -79.86 -46.11 17.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.372 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -109.3 91.92 3.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.133 0.492 . . . . 0.0 110.025 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.427 ' HB2' ' H ' ' A' ' 102' ' ' GLY . 11.0 pttm -103.5 -156.66 0.57 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.885 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 101' ' ' LYS . . . -63.97 91.42 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 113.089 -176.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -86.74 -40.32 15.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.5 tt -95.06 96.18 9.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.046 176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.36 149.65 22.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.712 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -95.22 54.77 1.68 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 -176.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.6 m80 69.98 120.93 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.257 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -73.2 132.35 43.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.693 -175.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -148.68 114.33 5.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.246 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 71.6 -44.66 0.6 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.686 0.794 . . . . 0.0 111.129 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.1 p80 . . . . . 0 C--O 1.245 0.853 0 CA-C-O 118.292 -0.861 . . . . 0.0 109.693 174.498 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.619 0.247 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.472 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 70.3 m-85 -81.68 142.71 32.45 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.877 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -131.69 135.47 46.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.026 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.17 122.51 47.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.183 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.531 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 88.6 tttt -109.01 107.23 17.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.421 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.633 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -65.84 122.3 17.01 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.545 HD13 HG13 ' A' ' 42' ' ' ILE . 43.2 pt -113.78 -24.14 3.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -178.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -102.59 105.16 15.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -176.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 116.58 -129.84 8.65 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.474 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 97.9 mttt -154.68 -46.18 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.9 p -136.21 153.82 51.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.645 172.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -162.41 116.45 1.79 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.757 0.313 . . . . 0.0 110.159 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.6 t-20 -90.76 112.31 24.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -178.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 HD21 ' A' ' 35' ' ' LEU . 54.9 t -104.2 108.69 25.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.793 177.144 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 65.41 -75.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.795 0.684 . . . . 0.0 111.364 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.85 6.19 1.81 Allowed Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.607 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.2 mp -115.84 119.39 61.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 22.2 m -92.83 105.7 17.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.972 0.415 . . . . 0.0 110.585 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -84.64 161.82 19.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.414 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 62.6 mtt180 -133.66 136.99 45.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.446 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.633 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.29 109.49 0.55 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.817 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.17 -7.55 30.85 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.516 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.6 t -111.21 127.2 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -179.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 12.1 p -102.95 104.21 14.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.42 177.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -102.02 149.83 23.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 0.0 110.819 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -73.52 132.74 43.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.814 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.8 m -126.9 155.35 75.69 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.328 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -64.26 151.93 83.39 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.692 2.261 . . . . 0.0 110.962 172.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' H ' ' HG3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -64.75 -20.78 66.54 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.882 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -68.5 -45.86 71.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.354 0.597 . . . . 0.0 110.228 174.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 77.7 mt -75.18 -26.22 58.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.499 -179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.472 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 84.9 t80 -57.32 -50.76 71.93 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.327 177.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 8.0 mm-40 -70.86 -33.43 70.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.131 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -62.31 -46.14 90.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 110.656 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.516 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.9 mt -79.24 -19.46 50.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.058 0.456 . . . . 0.0 110.344 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 33' ' ' GLU . 32.7 t30 -62.97 -31.87 73.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.798 174.162 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.48 -1.12 55.22 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.877 176.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -123.48 117.72 27.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 111.682 -174.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.57 39.47 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 123.293 2.662 . . . . 0.0 113.851 -175.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.446 ' HB2' ' CD1' ' A' ' 41' ' ' PHE . 72.4 m-85 -98.38 -18.44 18.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.066 0.46 . . . . 0.0 110.208 176.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.516 ' CE1' HD22 ' A' ' 35' ' ' LEU . 68.3 m-85 -127.35 147.24 50.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.778 -169.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.545 HG13 HD13 ' A' ' 7' ' ' ILE . 60.0 mt -97.71 103.72 15.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 162.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.44 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.3 mp -87.06 131.24 34.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.608 -174.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.2 m -118.69 127.89 54.0 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.613 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -90.14 106.79 18.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.365 0.602 . . . . 0.0 109.417 175.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 49' ' ' ASN . 9.0 mm-40 -102.06 124.06 47.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.074 -174.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -95.44 109.48 21.66 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.251 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.6 t30 63.33 79.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.927 0.767 . . . . 0.0 110.386 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.595 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 25.2 p-10 -112.36 29.44 7.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.595 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -60.58 105.72 0.47 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.081 -178.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.753 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 0.5 OUTLIER -108.03 110.46 22.17 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.482 177.682 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -59.4 140.54 56.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.486 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -114.99 106.38 51.67 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.321 177.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -69.86 88.64 0.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.874 2.382 . . . . 0.0 111.154 177.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.683 HG21 HD13 ' A' ' 77' ' ' LEU . 11.2 tp -174.89 31.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 122.418 1.104 . . . . 0.0 108.397 -178.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -149.57 96.57 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.91 -173.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -142.72 165.67 26.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.537 -176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.403 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 21.6 m -64.9 129.81 41.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.353 175.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.4 pm0 -61.77 -38.59 88.59 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 179.103 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.8 m -62.26 -30.97 71.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 36.5 tt0 -78.44 -35.0 47.46 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.348 0.594 . . . . 0.0 109.83 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.7 mt -77.64 -14.8 59.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.97 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 70.8 mmtt -66.06 -27.73 68.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 65' ' ' MET . . . -97.72 -148.52 23.96 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 169.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.473 ' HG3' ' OE1' ' A' ' 69' ' ' GLU . 43.6 ttm 68.75 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.106 0.479 . . . . 0.0 111.128 175.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -73.5 163.28 28.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.536 . . . . 0.0 111.153 -174.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -56.83 -41.41 77.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.156 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.36 90.87 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.221 0.326 . . . . 0.0 111.38 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.473 ' OE1' ' HG3' ' A' ' 65' ' ' MET . 47.7 mt-10 -60.1 -56.31 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.429 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.635 ' O ' HG13 ' A' ' 74' ' ' ILE . 80.1 m80 -51.11 -42.22 60.52 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.212 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 38.7 mt-10 -68.59 -41.52 79.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.748 -177.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 27.2 t -63.34 -41.64 98.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 69' ' ' GLU . 76.0 mt -52.95 -58.86 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.403 176.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.635 HG13 ' O ' ' A' ' 70' ' ' HIS . 7.2 mt -72.28 -24.25 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.528 -173.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.53 ' HA ' ' O ' ' A' ' 79' ' ' ARG . 49.9 m -74.94 -33.12 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.987 0.423 . . . . 0.0 110.008 175.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.1 -31.05 71.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.228 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.683 HD13 HG21 ' A' ' 55' ' ' ILE . 35.4 tp -61.62 -29.44 70.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.002 174.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 118.72 -7.07 13.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.934 -0.651 . . . . 0.0 111.507 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 mmt180 -90.49 -172.78 3.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.699 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 63.0 t30 -150.8 109.29 3.09 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.68 178.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.54 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 5.2 Cg_exo -77.79 54.0 4.63 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 123.218 2.612 . . . . 0.0 112.896 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.0 p -83.61 -37.32 23.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.22 0.533 . . . . 0.0 110.568 177.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -93.94 7.32 45.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.447 0.641 . . . . 0.0 110.48 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -105.5 108.53 20.1 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -97.42 -45.05 6.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -171.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.541 ' HB2' ' HG3' ' A' ' 89' ' ' GLU . 39.2 m-80 -80.53 168.01 19.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.234 0.54 . . . . 0.0 111.541 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 90' ' ' ARG . . . -81.05 -36.92 29.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.507 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.539 ' HA ' HD12 ' A' ' 91' ' ' ILE . 18.5 t70 -70.94 -32.77 69.75 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.863 -178.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.541 ' HG3' ' HB2' ' A' ' 86' ' ' ASN . 50.8 mt-10 -59.5 -46.33 89.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 110.748 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 18.2 ptp180 -71.3 -27.55 63.49 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.528 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 88' ' ' ASP . 96.6 mt -65.43 -45.95 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.89 -42.81 80.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.769 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.418 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 42.3 t80 -68.22 -39.15 82.43 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.793 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 55' ' ' ILE . 70.5 mt -66.04 -37.97 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.899 0.381 . . . . 0.0 110.283 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 98' ' ' ILE . 13.3 mt -65.29 -37.5 87.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.402 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.9 tmtm? -59.06 -31.15 68.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.939 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.616 ' HG3' ' CG1' ' A' ' 55' ' ' ILE . 7.5 mm-40 -74.27 -30.94 62.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.487 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.507 HD12 HD23 ' A' ' 95' ' ' LEU . 56.0 mt -67.65 -28.16 40.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.373 177.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -69.05 -18.6 64.03 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.96 0.409 . . . . 0.0 110.538 176.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -81.64 0.32 39.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.524 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -97.24 138.78 34.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.307 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -95.94 -117.19 3.23 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.696 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -111.97 148.75 33.11 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -175.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.6 128.65 34.71 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 167.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -62.03 112.4 2.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.051 0.453 . . . . 0.0 111.443 -171.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.38 -23.87 17.6 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 t60 56.36 41.07 29.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.934 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -80.57 124.84 29.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.657 -170.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 110' ' ' HIS . 18.9 t-80 -146.1 -71.44 0.25 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.597 172.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.44 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 47.8 t60 174.58 131.92 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 123.71 0.632 . . . . 0.0 110.215 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.0 p80 . . . . . 0 C--O 1.243 0.76 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 172.955 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.869 ' HB3' ' HB2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 90.0 m-85 -117.18 110.35 18.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.189 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -106.79 131.7 53.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.789 -177.744 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.47 137.28 53.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.172 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -139.59 137.91 35.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.757 0.313 . . . . 0.0 111.08 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -65.11 118.58 9.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.653 174.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.591 HG21 ' HB ' ' A' ' 42' ' ' ILE . 36.3 pt -100.26 -6.34 9.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.502 0.667 . . . . 0.0 109.796 175.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.6 tttp -140.19 130.79 25.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.483 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 109.12 -132.82 11.29 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.315 -0.945 . . . . 0.0 112.42 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -164.32 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.618 0.247 . . . . 0.0 110.364 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.514 HG22 ' HG2' ' A' ' 20' ' ' ARG . 12.4 p -145.16 134.99 23.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.238 179.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -147.18 128.07 14.44 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -97.5 107.86 20.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.793 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 35' ' ' LEU . 61.6 t -96.55 95.16 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.1 mtt 65.7 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.099 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -133.56 -1.87 3.73 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.938 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -102.06 113.81 39.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.5 m -87.99 116.55 26.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.733 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -98.59 151.09 21.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.735 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HG2' HG22 ' A' ' 11' ' ' THR . 15.5 mtp180 -132.32 137.84 47.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 109.9 1.02 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.028 0.442 . . . . 0.0 111.037 177.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.2 -3.32 28.32 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.308 -178.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -118.81 113.84 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.831 0.348 . . . . 0.0 111.026 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 3' ' ' THR . 33.6 m -85.09 126.05 33.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.262 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -129.17 151.48 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.37 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 1.2 p -80.92 138.59 36.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.855 0.359 . . . . 0.0 111.806 -176.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.9 153.4 81.7 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.959 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 7.6 Cg_exo -74.29 171.39 18.14 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 123.05 2.5 . . . . 0.0 112.264 175.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -51.9 -46.76 64.71 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.968 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.19 -45.34 94.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.411 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.8 mt -73.12 -28.93 62.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -58.44 -47.01 85.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -68.11 -41.29 81.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.575 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.98 -45.56 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.845 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 14' ' ' VAL . 87.2 mt -76.83 -23.44 52.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.84 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.69 -29.59 70.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.362 0.601 . . . . 0.0 109.705 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -78.07 -6.69 55.41 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 38.1 m-80 -118.87 101.5 50.23 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.61 -177.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 14.2 Cg_exo -69.42 11.66 0.35 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.523 2.816 . . . . 0.0 114.735 -171.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.552 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 17.7 p90 -105.18 10.57 33.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.258 0.552 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.443 ' CE2' HD22 ' A' ' 35' ' ' LEU . 45.1 m-85 -117.07 136.29 53.09 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.885 172.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.591 ' HB ' HG21 ' A' ' 7' ' ' ILE . 9.9 tt -97.25 133.5 38.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 167.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mp -120.79 141.56 50.4 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.162 0.506 . . . . 0.0 110.554 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -130.15 116.45 18.47 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.586 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -99.2 113.47 25.75 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.513 0.673 . . . . 0.0 110.327 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.869 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 81.7 mt-10 -101.93 109.17 20.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.987 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.95 96.33 9.22 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -127.53 17.94 6.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.617 0.722 . . . . 0.0 109.598 -175.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -149.89 159.17 44.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.138 -177.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -81.41 149.33 28.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.979 0.418 . . . . 0.0 110.805 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -119.49 138.62 53.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.189 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.5 t70 51.91 87.91 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.598 0.561 . . . . 0.0 111.057 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.481 ' OD2' HG22 ' A' ' 55' ' ' ILE . 20.1 t70 -52.62 116.3 8.62 Favored Pre-proline 0 N--CA 1.469 0.509 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.183 -170.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.45 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 74.4 Cg_endo -95.11 89.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.299 2.666 . . . . 0.0 113.633 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.531 HG12 HD13 ' A' ' 77' ' ' LEU . 9.3 tp 179.66 26.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.968 0.89 . . . . 0.0 109.666 174.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.466 ' HB2' HG12 ' A' ' 98' ' ' ILE . 6.5 p30 -161.88 105.3 1.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.793 -175.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.522 ' HB2' ' HG ' ' A' ' 62' ' ' LEU . 68.5 m-85 -142.89 161.65 37.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.039 -177.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 60' ' ' SER . 13.9 m -60.43 142.97 54.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.612 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 2.5 pp20? -60.01 -36.95 78.32 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.488 ' H ' HG22 ' A' ' 58' ' ' THR . 6.5 m -67.53 -29.19 68.53 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.187 176.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 33.5 tt0 -77.24 -34.51 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.88 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.522 ' HG ' ' HB2' ' A' ' 57' ' ' TYR . 87.5 mt -77.18 -21.24 54.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.11 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 29.4 mmtp -62.12 -40.24 95.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.906 172.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.82 47.68 2.5 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.155 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.482 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.9 mtt -141.03 136.52 32.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.464 ' ND2' ' HG2' ' A' ' 69' ' ' GLU . 11.2 p30 -71.17 173.2 7.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.015 0.436 . . . . 0.0 110.728 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.37 -41.21 94.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.009 -175.255 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.87 79.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.599 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.548 ' O ' HG13 ' A' ' 73' ' ' ILE . 58.7 mm-40 -59.6 -52.85 63.76 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.522 ' O ' HG13 ' A' ' 74' ' ' ILE . 53.0 m80 -52.46 -41.7 63.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.604 178.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 54.3 mt-10 -66.38 -45.64 79.38 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.709 -177.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.0 m -59.13 -47.0 86.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.666 0.269 . . . . 0.0 110.565 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.3 mt -50.99 -62.32 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.75 -178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.7 mt -74.59 -24.69 18.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.21 -172.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.0 t -68.04 -29.75 68.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -78.92 -25.17 43.69 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.911 0.386 . . . . 0.0 110.257 176.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.531 HD13 HG12 ' A' ' 55' ' ' ILE . 37.8 tp -67.59 -37.84 83.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.941 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.59 -1.49 10.26 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.688 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -107.1 133.71 51.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.848 0.356 . . . . 0.0 110.93 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.561 ' OD1' ' HB3' ' A' ' 82' ' ' SER . 23.9 t-20 -66.19 117.46 43.3 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.462 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.78 -5.6 17.49 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.632 2.221 . . . . 0.0 112.913 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.561 ' HB3' ' OD1' ' A' ' 80' ' ' ASN . 42.1 t -80.31 -9.01 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 177.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -69.57 -21.67 63.6 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -112.67 108.62 17.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.288 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -83.12 -41.72 18.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.259 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -89.36 150.48 22.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.068 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -37.96 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.355 176.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.32 -52.0 60.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.575 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -61.23 -43.57 98.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.025 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.415 ' O ' HG13 ' A' ' 94' ' ' ILE . 94.6 mtt180 -64.3 -41.89 96.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.319 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -66.77 -45.71 87.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.137 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 -38.65 80.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.818 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -70.91 -39.18 72.89 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.921 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.4 mt -66.07 -32.5 58.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.228 0.537 . . . . 0.0 109.94 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 HD12 ' A' ' 98' ' ' ILE . 4.0 mm? -73.86 -21.25 60.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.968 174.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -68.85 -33.05 73.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.717 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.75 -36.35 80.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 109.988 175.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.522 HD12 HD13 ' A' ' 95' ' ' LEU . 43.2 mt -67.61 -32.54 57.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.149 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.61 -42.96 97.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.614 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.4 -28.54 65.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.059 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 101' ' ' LYS . 55.9 tttm -77.96 -3.06 39.99 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.263 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.93 -21.06 60.74 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.076 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.25 155.82 33.82 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.4 tp -79.71 -41.59 26.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.528 ' OE2' ' HA ' ' A' ' 108' ' ' HIS . 31.5 tt0 -68.49 121.05 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -68.21 98.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.184 0.516 . . . . 0.0 111.828 -174.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 39.4 49.71 1.92 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.224 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.528 ' HA ' ' OE2' ' A' ' 105' ' ' GLU . 34.5 m170 69.98 137.92 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.191 -0.913 . . . . 0.0 113.303 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -69.56 128.63 37.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -57.22 -41.76 80.09 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -168.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p80 . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.183 -0.913 . . . . 0.0 109.395 177.466 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.661 ' HG3' ' H ' ' A' ' 2' ' ' PHE . 45.2 tpp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.661 ' H ' ' HG3' ' A' ' 1' ' ' MET . 63.5 m-85 -100.04 148.6 24.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.545 0.212 . . . . 0.0 110.723 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.6 p -121.29 132.22 54.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.139 0.495 . . . . 0.0 110.943 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.6 128.87 55.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.356 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.461 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 6.0 ttpm? -114.13 121.63 44.36 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.626 0.25 . . . . 0.0 110.502 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.628 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 55.2 tp -62.84 124.95 22.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.99 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.0 pt -120.43 5.42 6.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.761 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -132.89 104.76 6.74 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.365 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.86 -121.27 5.64 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.629 ' HD2' ' HB3' ' A' ' 21' ' ' ALA . 41.9 tptt -169.38 -45.66 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 p -135.56 113.45 11.09 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.561 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -123.12 112.8 18.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.273 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.503 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 28.2 t-20 -92.63 107.79 19.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.941 0.401 . . . . 0.0 110.528 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.32 110.3 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.733 177.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 65.17 -80.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.808 0.693 . . . . 0.0 111.091 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -137.31 -1.93 2.43 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.237 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -104.64 115.98 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -178.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.3 m -89.38 106.25 18.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.927 0.394 . . . . 0.0 110.396 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -85.38 146.6 26.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.211 178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 75.7 mtt180 -121.25 132.46 54.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.193 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.629 ' HB3' ' HD2' ' A' ' 10' ' ' LYS . . . -59.51 112.93 1.96 Allowed 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.024 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.51 -12.03 25.76 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.058 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.7 t -116.63 119.55 62.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.649 0.261 . . . . 0.0 111.129 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.423 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 9.7 m -82.29 123.24 28.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -119.1 143.94 46.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.75 0.31 . . . . 0.0 110.642 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -70.74 131.24 43.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.421 -175.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.2 m -131.19 151.4 78.81 Favored Pre-proline 0 C--O 1.235 0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.537 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.547 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.9 Cg_exo -68.43 166.16 26.54 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.81 2.34 . . . . 0.0 111.671 175.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -62.14 -33.9 75.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.286 -175.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.96 -46.25 90.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.775 0.321 . . . . 0.0 110.63 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.547 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.3 mt -74.54 -23.22 58.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.697 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -62.63 -46.48 88.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 176.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 24.5 tp10 -76.22 -34.61 59.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.216 0.531 . . . . 0.0 110.198 177.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.457 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 49.5 t80 -58.55 -48.55 80.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.269 177.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD22 ' CE2' ' A' ' 41' ' ' PHE . 79.6 mt -79.55 -15.19 58.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.684 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.466 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 45.1 t30 -62.01 -40.56 96.1 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 173.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.5 5.32 31.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.915 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 35' ' ' LEU . 32.0 m-80 -123.9 97.51 41.05 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.824 0.345 . . . . 0.0 110.427 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -70.77 63.93 2.39 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 123.4 2.733 . . . . 0.0 113.359 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.435 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 81.1 m-85 -120.43 -14.02 8.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.011 173.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.568 ' CE2' HD22 ' A' ' 35' ' ' LEU . 57.3 m-85 -129.21 151.42 49.9 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.211 -167.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.7 tt -97.24 118.45 43.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 166.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.6 mt -94.35 129.28 41.11 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.227 -175.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 m -142.62 147.17 35.37 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -114.69 105.03 12.57 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 172.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -106.72 111.37 23.87 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.338 -175.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.9 tp -98.35 147.14 24.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.644 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.27 89.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.258 0.552 . . . . 0.0 110.215 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -156.51 -41.1 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.689 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -92.4 8.18 39.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.885 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -144.25 134.74 24.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.759 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -127.86 172.63 10.69 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -123.36 80.2 53.33 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 110.157 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -96.04 57.25 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.633 2.889 . . . . 0.0 113.673 -171.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -174.94 35.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 122.293 1.044 . . . . 0.0 109.496 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -156.72 82.41 0.95 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.989 -172.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.413 ' N ' HD11 ' A' ' 98' ' ' ILE . 70.1 m-85 -142.37 150.06 40.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.687 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.937 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 14.0 m -60.82 138.75 58.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.562 0.22 . . . . 0.0 111.155 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.63 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.1 -37.43 77.13 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.171 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.55 ' H ' HG22 ' A' ' 58' ' ' THR . 18.6 m -70.01 -20.51 63.27 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.695 177.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.937 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 47.8 mm-40 -80.93 -45.62 16.42 Favored 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 120.227 -0.589 . . . . 0.0 109.713 173.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.456 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 87.4 mt -68.03 -18.58 64.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.842 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 1.6 mptm? -67.01 -33.46 75.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.943 0.402 . . . . 0.0 110.494 174.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.74 -22.01 27.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.049 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.9 mtp -73.32 136.69 44.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 110.423 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -70.65 167.36 18.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.261 -174.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 1.5 tmmt? -60.51 -41.24 93.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.9 68.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.862 176.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' O ' HG13 ' A' ' 73' ' ' ILE . 13.7 mm-40 -67.45 -50.01 61.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.204 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.456 ' HE1' ' O ' ' A' ' 62' ' ' LEU . 76.4 m80 -52.14 -44.5 64.59 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.698 175.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 86.4 mt-10 -60.42 -53.78 53.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.679 176.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.5 m -51.96 -44.39 63.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.972 0.415 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.1 mt -59.72 -62.52 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.711 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.588 HD12 ' HB3' ' A' ' 81' ' ' PRO . 4.4 mt -78.13 -10.4 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.627 -170.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m -80.82 -33.22 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.129 -0.357 . . . . 0.0 110.052 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -70.35 -27.11 64.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.108 0.48 . . . . 0.0 109.794 174.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.3 -23.35 65.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.968 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.41 18.61 52.22 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.579 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -40.08 6.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.659 0.229 . . . . 0.0 110.655 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 67.91 105.64 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.786 0.679 . . . . 0.0 110.832 -176.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.588 ' HB3' HD12 ' A' ' 74' ' ' ILE . 90.2 Cg_endo -84.2 34.17 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.805 2.337 . . . . 0.0 112.864 -177.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 p -76.41 -26.37 55.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.483 177.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.28 -31.99 62.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.435 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -82.56 108.86 16.27 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.57 -31.79 28.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.273 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.881 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 86.1 m-20 -92.27 141.69 28.29 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.62 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.276 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -60.4 -37.76 81.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.468 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.881 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 31.2 mm-40 -65.81 -35.05 79.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.465 0.65 . . . . 0.0 109.62 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -70.53 -35.4 73.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 176.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 87' ' ' ALA . 37.5 mm -61.93 -54.07 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -58.31 -40.27 81.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.869 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -67.7 -46.15 73.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.525 0.202 . . . . 0.0 111.067 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.76 -41.49 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.14 0.495 . . . . 0.0 109.885 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.523 HD13 HD12 ' A' ' 98' ' ' ILE . 4.2 mm? -67.99 -29.65 68.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.111 178.179 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 38.5 tptt -72.52 -18.43 61.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.058 0.456 . . . . 0.0 110.778 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.472 ' O ' ' HG3' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -83.15 -30.28 27.97 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 95' ' ' LEU . 39.4 mt -71.19 -35.61 58.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -63.61 -25.11 68.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.532 176.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -84.99 -17.31 37.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.246 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 97' ' ' GLN . 67.7 mttm -94.83 97.52 10.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.293 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 146.93 42.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.217 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 68.49 1.31 2.9 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 173.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.7 mp 50.82 57.69 6.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.06 160.14 32.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.304 -173.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -161.95 80.93 0.56 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.481 176.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -89.47 142.27 27.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.274 -173.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -149.09 116.96 6.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.286 177.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -79.11 166.5 22.2 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 176.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -74.98 71.98 2.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.151 0.501 . . . . 0.0 109.826 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 C--O 1.244 0.785 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.116 -178.42 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -92.33 113.11 25.3 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.8 p -114.9 148.36 38.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.966 0.412 . . . . 0.0 110.618 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -130.95 134.54 46.83 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.133 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.786 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 1.6 ttmp? -120.16 118.75 31.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.135 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.686 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 40.0 tp -71.3 128.2 35.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.821 HG13 ' HG3' ' A' ' 8' ' ' LYS . 41.5 pt -113.74 -17.16 8.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.866 0.365 . . . . 0.0 110.986 -177.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.821 ' HG3' HG13 ' A' ' 7' ' ' ILE . 96.5 mttt -133.1 138.69 46.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -177.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.66 -13.93 24.87 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.854 178.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.6 tttm 73.92 -52.89 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.532 0.733 . . . . 0.0 110.924 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.5 m -151.94 119.33 5.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.93 177.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.458 ' CE2' HG22 ' A' ' 14' ' ' VAL . 30.2 t80 -141.19 126.33 18.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.731 -178.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -92.14 125.49 36.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.912 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.458 HG22 ' CE2' ' A' ' 12' ' ' TYR . 47.9 t -104.81 104.94 17.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 175.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.5 mtt 65.41 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.112 -175.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.83 0.04 2.07 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.517 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.7 mp -101.3 123.48 54.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -178.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 m -83.31 116.61 22.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.943 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 96.9 m-85 -106.23 140.61 38.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.745 0.307 . . . . 0.0 110.189 175.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -127.66 148.28 50.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.686 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.21 112.29 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.624 0.249 . . . . 0.0 111.167 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.08 5.28 57.36 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.387 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.6 112.37 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.997 0.427 . . . . 0.0 110.15 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.786 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 16.0 m -92.45 123.98 36.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.63 150.41 51.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.819 0.343 . . . . 0.0 111.001 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 m -79.78 138.81 37.36 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.127 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.52 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 34.7 m -134.93 158.23 75.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.723 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.6 Cg_exo -68.95 171.32 13.76 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.769 2.313 . . . . 0.0 111.577 173.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.502 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 11.4 tmtt? -66.19 -31.13 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -177.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.84 -53.81 52.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.451 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.52 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 65.3 mt -70.23 -34.69 73.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.214 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -56.18 -46.77 79.26 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -71.53 -43.15 66.98 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.895 0.379 . . . . 0.0 110.574 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -58.0 -38.52 76.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.662 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.531 HD22 ' CE1' ' A' ' 41' ' ' PHE . 78.6 mt -88.75 -9.01 53.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.047 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -76.44 -23.94 53.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 172.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -84.41 -12.95 53.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.526 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -112.41 103.27 55.34 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.659 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.55 11.44 0.48 Allowed 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.411 2.74 . . . . 0.0 114.195 -173.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -85.1 -3.72 58.9 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.582 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 79.1 m-85 -118.82 131.47 56.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.11 -176.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.564 HG13 HD13 ' A' ' 7' ' ' ILE . 27.9 mt -97.45 104.12 15.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 166.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 4.7 mp -88.74 162.44 16.24 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.357 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m -149.91 154.31 38.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.001 -177.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -129.35 108.93 10.68 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -101.32 126.77 48.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.82 106.24 0.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.725 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -139.3 137.58 35.97 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 175.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.22 146.87 53.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.328 0.585 . . . . 0.0 111.679 -173.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -77.81 -174.93 3.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.792 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.428 ' HE3' ' HB2' ' A' ' 51' ' ' LYS . 25.8 ttmt -74.29 157.47 35.73 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -75.47 -173.19 2.04 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -55.43 126.45 62.78 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.342 -171.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.551 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 71.8 Cg_endo -77.71 46.94 2.17 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 123.269 2.646 . . . . 0.0 112.465 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.669 HG12 HD13 ' A' ' 77' ' ' LEU . 9.6 tp -170.7 22.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.454 1.121 . . . . 0.0 109.042 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.472 ' HA ' HG12 ' A' ' 98' ' ' ILE . 39.5 t30 -159.11 98.86 1.47 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.679 -173.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.551 ' OH ' ' HA ' ' A' ' 54' ' ' PRO . 95.9 m-85 -140.11 -174.66 3.99 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.51 -176.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.729 ' HB ' ' HB3' ' A' ' 61' ' ' GLU . 3.0 m -79.59 129.47 34.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.583 ' HB3' HD21 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -63.29 -39.65 95.17 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.822 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.51 ' HA ' ' HE3' ' A' ' 63' ' ' LYS . 50.2 m -64.95 -29.3 70.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.978 0.418 . . . . 0.0 109.971 174.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.729 ' HB3' ' HB ' ' A' ' 58' ' ' THR . 39.7 tt0 -76.23 -38.75 55.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.96 -27.52 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.245 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 60' ' ' SER . 48.3 mtmt -76.42 -1.24 26.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.26 26.46 8.2 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 172.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.506 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 24.1 mmt -119.33 161.71 20.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.554 -0.323 . . . . 0.0 110.444 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 16.2 m-80 -91.62 -167.81 1.88 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.472 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -79.46 -35.22 40.69 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.229 -177.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.12 77.23 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.409 0.443 . . . . 0.0 112.017 -171.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HG3' ' HB3' ' A' ' 65' ' ' MET . 2.6 pm0 -63.03 -47.0 84.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.775 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.52 ' HE1' HG12 ' A' ' 91' ' ' ILE . 19.7 m-70 -55.31 -41.37 72.28 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.565 0.222 . . . . 0.0 111.079 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.485 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 42.6 mt-10 -65.73 -50.15 65.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.986 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 m -58.59 -38.11 77.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.481 HG23 ' O ' ' A' ' 54' ' ' PRO . 69.1 mt -54.61 -61.97 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.407 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.518 HD12 ' HB3' ' A' ' 81' ' ' PRO . 2.0 mt -79.3 -21.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.983 -170.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.5 p -71.19 -25.5 62.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.541 -0.464 . . . . 0.0 109.779 175.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -76.25 -33.35 59.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.107 172.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.669 HD13 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -62.47 -38.89 91.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.117 0.484 . . . . 0.0 110.708 174.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.32 -46.99 1.04 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.233 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.521 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 48.8 ttt85 -77.37 111.7 13.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.134 0.492 . . . . 0.0 109.768 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -62.32 130.66 93.33 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.085 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.518 ' HB3' HD12 ' A' ' 74' ' ' ILE . 91.9 Cg_endo -86.53 24.92 0.71 Allowed 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 123.254 2.636 . . . . 0.0 112.718 -177.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.2 m -73.65 -36.81 65.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.921 0.391 . . . . 0.0 110.344 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -73.59 -27.42 61.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.535 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.421 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 87.7 m-85 -82.52 108.88 16.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.293 177.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 37.3 ttmt -99.37 -54.61 2.91 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.05 -171.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -83.15 158.47 22.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.903 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.11 73.23 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.173 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -50.44 -49.23 55.57 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.637 0.586 . . . . 0.0 110.882 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.18 -49.39 74.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.981 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.7 mtt180 -64.2 -43.52 94.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.085 -176.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.52 HG12 ' HE1' ' A' ' 70' ' ' HIS . 91.1 mt -71.3 -43.88 73.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.178 -176.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -58.81 -40.21 83.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 111.174 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.521 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 41.9 t80 -68.1 -42.57 80.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.47 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.503 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.9 mt -60.92 -39.71 82.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.583 HD21 ' HB3' ' A' ' 59' ' ' GLU . 38.3 mt -55.55 -40.73 72.26 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.025 177.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 92' ' ' ALA . 66.0 mttm -60.33 -34.27 73.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.391 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -83.55 -18.99 36.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.014 0.435 . . . . 0.0 110.621 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.532 HD12 HD23 ' A' ' 95' ' ' LEU . 78.1 mt -70.07 -41.79 79.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.912 176.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -75.84 -48.22 22.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.559 176.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -120.22 88.4 2.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.125 0.488 . . . . 0.0 111.117 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -90.6 -44.15 9.72 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 78.06 -61.2 3.8 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.505 -0.77 . . . . 0.0 113.89 172.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.752 ' HG2' ' H ' ' A' ' 104' ' ' LEU . 21.3 tt0 66.68 -156.85 0.24 Allowed 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -172.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.752 ' H ' ' HG2' ' A' ' 103' ' ' GLU . 8.2 mp 56.75 62.74 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.263 0.554 . . . . 0.0 109.545 -175.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.34 -47.07 74.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.119 -173.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -162.29 118.36 1.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.111 0.481 . . . . 0.0 111.011 -176.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.532 ' O ' ' HB3' ' A' ' 108' ' ' HIS . 76.1 t60 -161.6 143.61 11.66 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.527 -0.761 . . . . 0.0 108.976 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.532 ' HB3' ' O ' ' A' ' 107' ' ' HIS . 36.9 t60 78.84 -37.92 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.602 0.564 . . . . 0.0 110.418 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -68.85 120.19 14.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 172.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 30.0 p80 -134.57 177.12 8.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.427 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.337 -0.839 . . . . 0.0 109.215 173.438 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -124.08 161.45 25.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.299 . . . . 0.0 110.571 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 p -127.42 139.55 52.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.431 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.17 128.2 54.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -111.32 105.5 14.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.018 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 50.6 tp -65.72 116.89 7.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.562 HG21 HG13 ' A' ' 42' ' ' ILE . 42.5 pt -107.1 -29.87 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.811 0.339 . . . . 0.0 111.58 -175.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 50.4 mttm -106.5 128.91 54.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.322 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.24 -128.51 8.57 Favored Glycine 0 N--CA 1.441 -0.981 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.126 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -170.12 -46.94 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -175.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.26 113.49 6.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.685 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -123.1 104.21 9.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.338 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 23.8 t-20 -90.23 122.2 32.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.848 0.356 . . . . 0.0 111.034 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.8 t -119.99 111.78 34.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.763 174.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.1 mtt 64.52 -95.29 0.04 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.884 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.94 17.42 6.33 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.056 -0.593 . . . . 0.0 111.712 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 HD11 ' A' ' 31' ' ' LEU . 4.6 mp -123.42 110.87 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 30.5 m -90.53 107.34 19.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.631 177.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 91.9 m-85 -84.91 151.02 24.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 179.211 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 46.6 mtm180 -133.83 145.68 49.93 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.562 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -54.61 114.82 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.993 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.84 -7.16 67.54 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.626 177.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.6 t -100.82 125.43 54.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.873 0.368 . . . . 0.0 111.275 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 m -94.59 121.73 36.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.122 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -124.57 146.06 49.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.601 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.8 m -75.13 126.71 31.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.6 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.9 m -122.75 154.33 63.65 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-O 120.678 0.275 . . . . 0.0 111.45 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.565 ' HD2' HD12 ' A' ' 31' ' ' LEU . 21.2 Cg_exo -66.86 164.23 30.4 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.8 2.334 . . . . 0.0 111.015 172.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -64.19 -32.58 74.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.001 -175.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -54.57 -52.02 63.44 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.995 0.426 . . . . 0.0 110.489 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 28' ' ' PRO . 49.3 mt -67.92 -33.63 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.472 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 87.4 t80 -59.13 -44.13 92.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.879 0.371 . . . . 0.0 110.305 178.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -77.7 -40.17 42.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -59.76 -40.43 88.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.329 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -87.67 -13.48 42.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 8.1 t30 -63.83 -36.9 85.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.16 8.18 16.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.468 176.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 31.5 m-80 -127.99 91.93 43.46 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.118 0.485 . . . . 0.0 110.157 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -75.14 57.0 4.51 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.745 2.963 . . . . 0.0 114.643 -169.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 3.3 p90 -133.58 22.36 3.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.649 0.738 . . . . 0.0 110.121 170.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.79 148.93 50.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.766 175.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 HG21 ' A' ' 7' ' ' ILE . 50.3 mt -97.03 110.09 24.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 163.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 68.6 mt -91.84 133.1 35.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.367 -175.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.29 168.94 18.68 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.419 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -136.5 104.86 5.71 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 167.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -104.57 167.62 9.62 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.048 -171.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -92.95 166.74 12.24 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.847 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -130.9 -53.99 1.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.468 178.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -73.09 106.91 5.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.795 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 43.6 tt0 -126.98 -5.22 6.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.327 0.584 . . . . 0.0 109.907 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.467 ' C ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -96.48 16.59 18.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.756 -174.924 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -76.44 176.63 8.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.746 0.308 . . . . 0.0 110.754 -175.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.35 151.16 41.21 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.815 -177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.423 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 11.9 Cg_exo -71.0 94.46 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.938 2.426 . . . . 0.0 113.033 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.83 HG12 HD13 ' A' ' 77' ' ' LEU . 9.5 tp -179.47 26.67 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 122.047 0.927 . . . . 0.0 109.716 175.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.538 ' HB3' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -163.78 98.09 0.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.654 -174.025 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -142.3 160.13 40.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.502 -177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.498 ' HB ' ' H ' ' A' ' 61' ' ' GLU . 1.7 m -57.16 137.3 56.04 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.467 0.479 . . . . 0.0 110.175 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HB3' HD11 ' A' ' 95' ' ' LEU . 0.6 OUTLIER -62.81 -31.17 72.11 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.369 -0.532 . . . . 0.0 109.865 176.8 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.2 t -64.87 -41.38 95.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.599 172.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -68.35 -42.17 79.65 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.35 179.525 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.456 HD23 ' SD ' ' A' ' 65' ' ' MET . 99.9 mt -66.39 -32.62 74.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.41 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HG3' HD13 ' A' ' 91' ' ' ILE . 43.1 mtmt -76.71 -16.96 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.055 0.455 . . . . 0.0 110.538 175.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.05 23.27 36.63 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.636 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.1 mtt -117.67 160.71 20.85 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.271 0.558 . . . . 0.0 111.042 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.572 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 38.6 t30 -74.02 152.54 39.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.055 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 49.4 mtmt -52.45 -47.07 66.64 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.337 177.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.3 64.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.776 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 26.8 mm-40 -66.21 -44.45 83.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.579 ' O ' HG13 ' A' ' 74' ' ' ILE . 76.3 m-70 -57.64 -42.84 84.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.09 0.472 . . . . 0.0 110.247 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 4.3 mm-40 -63.5 -46.25 86.96 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.65 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.8 p -72.57 -36.18 68.14 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.643 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 69' ' ' GLU . 81.7 mt -56.6 -55.86 17.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.18 0.514 . . . . 0.0 110.716 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.4 mt -77.14 -18.58 14.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.019 0.438 . . . . 0.0 110.537 -175.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.1 t -64.65 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.11 -34.97 79.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.297 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.83 HD13 HG12 ' A' ' 55' ' ' ILE . 58.2 tp -59.06 -34.89 72.48 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.183 0.515 . . . . 0.0 110.545 174.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.22 14.73 11.4 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.036 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HD3' ' OH ' ' A' ' 93' ' ' TYR . 48.9 ttt180 -145.78 92.76 2.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.147 0.498 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.578 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 51.0 t30 -58.67 132.48 85.99 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.676 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.578 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 85.2 Cg_exo -44.95 84.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.987 3.125 . . . . 0.0 113.575 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.3 t -78.83 108.63 12.41 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.925 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.5 t70 51.68 62.05 2.9 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.978 0.799 . . . . 0.0 111.731 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -116.97 108.09 15.36 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 171.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -99.6 -32.4 11.11 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.065 0.46 . . . . 0.0 110.246 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -72.1 124.33 24.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.98 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.43 88.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.888 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.56 -25.87 67.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.288 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -67.38 -42.68 82.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.685 0.279 . . . . 0.0 110.551 -177.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 mtt-85 -62.07 -43.59 98.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.372 0.606 . . . . 0.0 109.779 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.411 HD13 ' HG3' ' A' ' 63' ' ' LYS . 45.1 mt -67.63 -42.51 86.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.229 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.35 78.17 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.271 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.438 ' OH ' ' HD3' ' A' ' 79' ' ' ARG . 30.1 t80 -68.91 -38.84 79.83 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.206 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.445 ' O ' HG13 ' A' ' 98' ' ' ILE . 73.6 mt -65.82 -47.16 86.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.02 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 59' ' ' GLU . 95.1 mt -62.09 -38.36 88.58 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.082 0.468 . . . . 0.0 111.013 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -61.85 -36.5 81.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.426 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -72.91 -22.51 60.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.836 -179.383 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.538 HG12 ' HB3' ' A' ' 56' ' ' ASN . 53.6 mt -73.57 -40.31 54.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 109.686 175.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.64 -28.49 62.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.156 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -95.44 13.01 27.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.807 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 97' ' ' GLN . 83.5 tttt -96.08 112.13 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.923 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 132.17 83.18 0.24 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -175.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -64.73 106.66 1.24 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.829 0.347 . . . . 0.0 111.279 -175.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.4 tt -82.33 74.99 9.27 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -106.13 157.64 17.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.021 -177.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -67.24 154.61 40.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.701 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -57.29 128.06 35.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.51 72.65 5.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.212 0.53 . . . . 0.0 111.728 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -90.07 10.65 23.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.572 175.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -83.46 13.41 4.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.755 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.486 -0.768 . . . . 0.0 109.742 176.2 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 121.047 0.451 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.417 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 61.3 m-85 -124.29 121.44 35.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.484 176.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.4 t -126.37 147.39 49.77 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.63 135.23 54.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.933 0.397 . . . . 0.0 110.918 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -119.4 118.35 30.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.462 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.66 130.42 43.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 42' ' ' ILE . 40.4 pt -120.14 -0.52 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.835 0.35 . . . . 0.0 111.408 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 88.7 tttt -135.71 121.54 19.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.79 -174.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 100.43 -125.05 8.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.45 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 38.6 ttmt -155.37 -52.08 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.5 m -144.29 126.48 15.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.907 0.384 . . . . 0.0 111.168 -178.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -142.5 131.04 22.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.033 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 65.1 t30 -93.92 120.54 34.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.113 0.482 . . . . 0.0 111.166 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 90.7 t -99.89 95.17 3.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.914 176.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.3 mtt 62.8 -81.02 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.826 -176.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.17 -2.13 5.59 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.96 177.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -103.57 105.62 18.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -178.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 4.1 m -86.2 117.69 25.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.878 0.371 . . . . 0.0 110.545 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 25' ' ' GLN . 96.1 m-85 -103.88 152.95 21.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 36.5 mtm180 -124.09 139.77 53.61 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.821 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.774 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -51.13 118.63 3.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.108 0.48 . . . . 0.0 111.24 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.89 -22.46 35.23 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.3 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -93.16 122.4 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 110.698 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -95.19 125.55 39.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.746 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 19' ' ' PHE . 25.9 mt-30 -130.87 140.72 50.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.061 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.0 p -67.7 133.25 48.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.741 -175.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -121.96 149.63 54.29 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.327 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.544 ' HD2' HD12 ' A' ' 31' ' ' LEU . 22.5 Cg_exo -65.74 163.12 31.72 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.766 2.311 . . . . 0.0 110.774 171.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -63.27 -29.04 70.44 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.433 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.75 -53.69 50.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.437 175.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.544 HD12 ' HD2' ' A' ' 28' ' ' PRO . 67.2 mt -67.98 -25.55 65.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.038 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 81.2 t80 -59.68 -47.26 86.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 176.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -73.21 -38.75 65.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.807 0.337 . . . . 0.0 110.628 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.414 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 86.9 t80 -58.29 -47.64 83.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.914 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.55 ' HB2' HD21 ' A' ' 43' ' ' LEU . 89.2 mt -80.63 -22.21 40.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.035 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 53.3 t30 -63.29 -28.79 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.512 0.673 . . . . 0.0 109.729 174.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -81.39 0.05 39.19 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.59 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -121.76 116.61 30.28 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.205 0.526 . . . . 0.0 111.258 -176.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.59 10.37 2.25 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 123.169 2.579 . . . . 0.0 114.605 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 5.4 p90 -107.02 12.09 29.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.438 0.637 . . . . 0.0 110.482 177.235 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -127.35 127.58 44.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.325 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 7' ' ' ILE . 50.4 mt -97.52 109.96 24.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.55 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.2 mp -94.83 149.78 20.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.822 -178.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.7 m -128.79 117.3 20.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -101.39 122.97 44.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.484 172.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -102.44 108.31 19.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.9 mp -86.5 96.22 9.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.577 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -120.33 23.78 10.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.068 177.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -85.39 -50.41 7.33 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.92 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -139.85 82.19 1.86 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 174.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -97.13 -12.58 22.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.21 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.463 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 11.2 m-20 -96.89 176.38 5.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.458 178.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -90.77 113.12 56.81 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.816 -171.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 52' ' ' ASP . 86.6 Cg_endo -100.46 -175.55 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 123.485 2.79 . . . . 0.0 111.967 172.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.666 HG12 HD22 ' A' ' 77' ' ' LEU . 10.7 tp 38.78 61.2 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.863 0.865 . . . . 0.0 112.951 173.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -174.43 87.52 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.586 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -142.86 161.94 36.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.736 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.643 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 2.0 m -74.19 143.74 45.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.627 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -34.69 78.77 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.357 0.599 . . . . 0.0 109.959 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.6 m -75.83 -25.95 56.74 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.582 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.643 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 56.2 tt0 -77.19 -44.81 28.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.405 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.478 HD23 ' SD ' ' A' ' 65' ' ' MET . 89.9 mt -65.2 -33.6 76.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.585 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -72.45 -12.75 61.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.843 176.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.56 28.48 13.26 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 176.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.478 ' SD ' HD23 ' A' ' 62' ' ' LEU . 58.2 mtt -119.67 -171.24 2.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 111.078 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.494 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 9.7 t-20 -114.7 162.92 16.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.668 176.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 18.9 ptmt -56.05 -40.24 73.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.72 -49.68 74.44 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -170.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.536 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 pm0 -59.39 -46.88 87.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.077 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.446 ' O ' HG13 ' A' ' 74' ' ' ILE . 72.2 m80 -50.38 -50.7 50.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.972 0.415 . . . . 0.0 110.922 177.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 4.0 mm-40 -61.88 -43.66 98.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.704 -176.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -63.03 -44.4 96.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.742 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.8 mt -52.63 -58.33 2.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.919 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.478 HD12 ' HB3' ' A' ' 81' ' ' PRO . 0.8 OUTLIER -75.48 -21.88 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.043 -172.75 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.9 m -70.63 -23.95 62.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.848 0.356 . . . . 0.0 110.699 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -82.96 -30.11 28.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.101 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.666 HD22 HG12 ' A' ' 55' ' ' ILE . 51.2 tp -67.75 -37.97 82.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.848 174.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 133.94 -60.82 0.65 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.016 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 62.1 ttt180 -65.92 108.1 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -63.74 142.36 98.04 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.649 -175.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 55.2 Cg_endo -67.13 -7.6 19.31 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 123.569 2.846 . . . . 0.0 112.51 -176.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.7 m -64.25 -17.58 63.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.77 179.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -76.2 -20.34 57.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.257 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -111.11 112.72 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.016 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.75 -36.04 32.51 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -173.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.4 ' HB3' ' OD1' ' A' ' 88' ' ' ASP . 66.8 t30 -107.01 164.22 12.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.74 0.305 . . . . 0.0 110.642 -176.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.436 ' HA ' ' HD2' ' A' ' 90' ' ' ARG . . . -64.89 -34.12 77.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.847 -177.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.4 ' OD1' ' HB3' ' A' ' 86' ' ' ASN . 22.8 p-10 -64.24 -47.4 79.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.207 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -60.25 -38.25 82.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.911 0.386 . . . . 0.0 110.843 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 87' ' ' ALA . 55.3 mtt85 -58.78 -52.22 66.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.431 175.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.77 -44.54 96.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.258 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.24 -41.32 75.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.432 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 27.2 t80 -72.58 -34.86 67.74 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.998 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.8 mt -67.77 -41.87 85.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 98' ' ' ILE . 4.4 mm? -65.71 -38.53 89.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.766 176.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -57.33 -37.71 72.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.929 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -7.77 59.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.948 -175.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 95' ' ' LEU . 27.9 mt -72.91 -44.82 57.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 173.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -78.94 -13.54 59.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.571 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -61.39 -25.26 67.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.708 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.94 120.93 12.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.497 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -122.98 -32.89 0.88 Allowed Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.006 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -111.08 85.2 2.07 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.054 0.454 . . . . 0.0 110.11 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 67.9 tp -103.27 -47.32 4.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.13 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.405 ' HB3' ' H ' ' A' ' 106' ' ' HIS . 22.8 mt-10 -100.98 -160.75 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.618 178.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.405 ' H ' ' HB3' ' A' ' 105' ' ' GLU . 10.6 p80 -122.73 87.85 2.82 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.395 0.617 . . . . 0.0 111.585 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -136.54 8.84 3.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.798 0.809 . . . . 0.0 108.868 170.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 66.6 t60 -103.66 21.22 16.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.289 -178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -91.38 -20.49 21.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.766 -174.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -109.8 119.53 39.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.797 0.332 . . . . 0.0 111.753 -172.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.62 -0.705 . . . . 0.0 109.538 174.734 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.514 ' HG3' ' OD1' ' A' ' 48' ' ' ASN . 64.6 mtm . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -114.1 131.34 56.44 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.9 p -122.9 136.35 54.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.771 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.4 117.72 29.25 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.657 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.448 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 34.9 ttpt -106.63 121.22 43.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.062 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.825 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 26.0 tp -66.42 116.08 7.04 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.557 HG13 ' HG3' ' A' ' 8' ' ' LYS . 31.9 pt -106.15 -13.08 9.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 120.96 0.41 . . . . 0.0 111.586 -174.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HG3' HG13 ' A' ' 7' ' ' ILE . 95.2 mttt -130.36 109.88 11.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.183 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.6 -120.49 2.56 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.229 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -171.72 -66.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 m -135.05 113.05 11.06 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.45 ' CE2' HG22 ' A' ' 14' ' ' VAL . 26.1 t80 -133.08 130.55 39.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.95 0.405 . . . . 0.0 111.056 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -97.65 125.53 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.831 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 35' ' ' LEU . 44.4 t -112.58 115.89 51.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.421 ' SD ' HD21 ' A' ' 31' ' ' LEU . 61.4 mtt 67.88 -73.85 0.08 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.478 0.711 . . . . 0.0 111.076 -177.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 19.75 0.28 Allowed Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.469 HD13 HD11 ' A' ' 31' ' ' LEU . 3.9 mp -118.15 137.34 52.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.0 m -95.08 118.0 31.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 111.548 -176.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 77.5 m-85 -106.16 140.11 39.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.028 177.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.402 ' HB2' ' HB ' ' A' ' 23' ' ' VAL . 79.3 mtp180 -122.82 142.46 50.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.096 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.825 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -65.54 106.13 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.003 0.43 . . . . 0.0 110.725 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 109.6 -5.38 31.19 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.204 -178.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.402 ' HB ' ' HB2' ' A' ' 20' ' ' ARG . 61.0 t -113.61 122.11 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.838 0.351 . . . . 0.0 110.705 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 12.4 m -82.13 100.59 9.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.216 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -86.72 142.26 28.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.624 -176.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.5 m -81.1 125.43 30.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.65 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 33.0 m -130.49 155.82 80.53 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.253 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -74.27 162.22 38.96 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.53 2.153 . . . . 0.0 110.539 170.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 83.1 tttt -60.55 -23.81 64.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.61 0.243 . . . . 0.0 110.824 -178.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -56.6 -52.08 66.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.083 0.468 . . . . 0.0 109.893 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 59.2 mt -75.78 -29.06 58.63 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.768 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 89.8 t80 -57.47 -43.26 83.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.006 0.432 . . . . 0.0 110.513 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -80.09 -40.01 28.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.27 0.557 . . . . 0.0 110.305 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.19 -35.1 76.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.958 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 14' ' ' VAL . 90.3 mt -92.68 -15.72 26.39 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.259 -0.276 . . . . 0.0 110.901 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.43 -37.38 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.0 109.817 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.73 6.61 10.38 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.67 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -116.15 113.78 41.34 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.046 0.451 . . . . 0.0 110.424 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.92 23.74 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 123.206 2.604 . . . . 0.0 114.517 -171.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 6.8 p90 -122.25 16.69 10.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.498 0.666 . . . . 0.0 110.392 175.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.507 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.49 135.5 49.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.779 173.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.448 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.7 tt -98.81 128.37 50.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.97 118.17 32.67 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.166 -0.613 . . . . 0.0 111.371 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -112.34 142.27 45.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.967 -176.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -100.51 105.68 17.14 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.94 23.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.376 0.608 . . . . 0.0 111.749 -173.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.9 mp -83.4 122.78 28.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.778 -177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.514 ' OD1' ' HG3' ' A' ' 1' ' ' MET . 12.0 m120 -97.05 172.39 7.88 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.483 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -90.01 143.94 26.35 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -57.78 137.88 56.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.201 0.524 . . . . 0.0 110.794 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -87.08 -21.43 26.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.051 -171.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -117.09 114.91 24.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.152 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -129.63 114.74 18.06 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -179.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.5 ' O ' HG22 ' A' ' 55' ' ' ILE . 17.2 Cg_endo -57.18 142.43 94.48 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 123.188 2.592 . . . . 0.0 113.436 -173.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' O ' ' A' ' 54' ' ' PRO . 7.6 tp 52.29 26.84 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.389 1.075 . . . . 0.0 111.951 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.427 ' HB2' ' HE3' ' A' ' 101' ' ' LYS . 6.2 t30 -147.62 80.75 1.5 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.448 0.642 . . . . 0.0 109.68 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -138.23 159.36 42.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.712 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.59 148.38 35.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.631 174.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 35.5 tt0 -57.43 -42.76 83.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 176.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m -59.85 -32.67 70.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.189 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.66 -37.27 59.75 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.102 0.477 . . . . 0.0 110.393 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.511 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 85.8 mt -81.25 -18.99 44.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.957 -177.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 31.2 mmtp -65.15 -29.81 70.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.973 0.416 . . . . 0.0 110.996 177.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.09 2.52 79.27 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.358 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.43 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -103.19 137.78 40.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.778 0.323 . . . . 0.0 110.222 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -74.78 171.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.776 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.572 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -58.2 -36.97 73.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.073 -178.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.88 91.33 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.541 0.526 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 mp0 -57.41 -47.13 82.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.901 0.382 . . . . 0.0 110.382 177.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.587 ' O ' HG13 ' A' ' 74' ' ' ILE . 57.5 m80 -58.22 -41.63 84.52 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 177.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 43.4 mt-10 -59.57 -49.75 76.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.239 -178.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 p -63.99 -34.29 77.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.664 0.269 . . . . 0.0 111.259 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.7 mt -61.39 -54.88 29.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.16 0.505 . . . . 0.0 111.006 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.587 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.7 mt -75.34 -21.53 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.799 -174.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 73.9 m -64.57 -37.3 87.07 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -68.23 -34.26 75.91 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.179 175.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.473 HD13 HG21 ' A' ' 55' ' ' ILE . 42.8 tp -64.81 -37.63 88.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.775 175.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.36 23.16 5.84 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.728 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.523 ' HB3' HG22 ' A' ' 74' ' ' ILE . 3.9 tpt180 -125.31 131.65 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -66.02 116.12 29.74 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 121.513 0.673 . . . . 0.0 110.331 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -83.38 -5.33 11.01 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.827 2.352 . . . . 0.0 113.167 -175.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.5 t -77.57 -0.13 25.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.404 178.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -77.81 -15.89 58.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.413 0.625 . . . . 0.0 109.713 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -102.52 128.04 49.32 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.002 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -84.83 -26.02 27.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.905 0.383 . . . . 0.0 111.09 -173.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.521 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 30.4 p30 -126.01 169.75 12.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.332 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.29 -18.24 59.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.589 0.233 . . . . 0.0 111.271 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.09 -49.27 68.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.894 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -62.94 -32.62 73.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.823 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 46.4 mtt-85 -65.35 -40.02 93.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.987 178.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.0 mt -62.83 -47.44 92.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.199 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.92 -39.72 78.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.621 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.98 -45.39 77.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.791 0.329 . . . . 0.0 110.39 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.9 mt -66.21 -39.13 83.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.505 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 91' ' ' ILE . 56.3 mt -65.77 -30.05 70.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.833 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -80.56 -34.73 35.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.257 0.551 . . . . 0.0 110.32 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.66 -30.57 56.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.408 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.449 ' HA ' ' HD2' ' A' ' 101' ' ' LYS . 10.5 tt -69.44 -23.98 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 121.173 0.511 . . . . 0.0 109.794 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -72.22 -42.17 66.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.288 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -91.65 64.1 4.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.746 -178.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 98' ' ' ILE . 8.9 mtpm? -129.27 80.36 1.96 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.727 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -171.38 81.99 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.353 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -88.16 14.39 9.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.976 0.417 . . . . 0.0 111.157 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.55 102.66 14.8 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -92.84 149.81 21.02 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.534 -171.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -146.82 106.54 3.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.462 173.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -106.74 150.64 26.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.303 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -67.67 114.41 6.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.479 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -74.21 134.72 42.73 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -59.98 -61.39 2.64 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.591 0.234 . . . . 0.0 110.945 -173.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.285 -0.864 . . . . 0.0 109.718 175.604 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.466 ' SD ' HG22 ' A' ' 26' ' ' THR . 13.3 tmm? . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -114.65 142.57 46.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.582 0.23 . . . . 0.0 111.018 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 24' ' ' SER . 26.0 p -129.6 142.78 50.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.842 0.353 . . . . 0.0 111.288 177.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.518 ' O ' ' HA ' ' A' ' 24' ' ' SER . . . -118.52 140.93 49.11 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 36.3 ttpt -122.07 123.29 41.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.146 0.498 . . . . 0.0 111.412 -175.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.525 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 3.4 tm? -73.86 125.28 27.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.182 176.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.551 HD13 HG13 ' A' ' 42' ' ' ILE . 43.4 pt -112.12 -15.06 10.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.601 -178.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.463 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 83.2 tttt -140.99 113.66 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.632 0.253 . . . . 0.0 110.811 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.68 -5.69 5.5 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.232 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? 73.6 -53.75 0.69 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.086 0.554 . . . . 0.0 110.784 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.496 HG22 ' HG2' ' A' ' 20' ' ' ARG . 1.4 p -147.02 142.2 27.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.378 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -152.91 140.34 19.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -107.76 129.36 55.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.936 -177.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -126.84 101.2 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.373 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' MET . . . . . 0.515 ' SD ' HD21 ' A' ' 31' ' ' LEU . 65.9 mtt 56.05 32.98 21.03 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.666 176.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.35 -24.76 26.76 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.324 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.09 118.6 21.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 20.5 m -100.05 105.45 17.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.178 0.513 . . . . 0.0 111.053 -176.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.525 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 95.2 m-85 -92.44 153.25 19.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.016 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HG2' HG22 ' A' ' 11' ' ' THR . 83.3 mtt85 -133.57 153.91 51.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.412 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.51 111.06 0.8 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.994 0.426 . . . . 0.0 111.218 176.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.8 6.37 67.52 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.636 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 87.9 t -114.55 110.32 31.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.04 0.448 . . . . 0.0 111.139 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.532 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 24.8 p -86.7 114.94 23.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.686 174.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -110.51 159.27 17.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.466 HG22 ' SD ' ' A' ' 1' ' ' MET . 12.4 p -67.45 135.23 52.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.949 0.404 . . . . 0.0 112.022 -175.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 31.4 m -129.76 144.08 51.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.188 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.555 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -66.21 167.89 17.23 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 123.24 2.626 . . . . 0.0 112.211 174.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -55.66 -40.28 72.05 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.421 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -75.57 -34.15 60.66 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.227 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.555 HD12 ' HD2' ' A' ' 28' ' ' PRO . 34.9 mt -75.99 -25.6 55.94 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.036 -179.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.48 -42.88 97.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.962 0.41 . . . . 0.0 110.087 176.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.96 -38.06 46.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.53 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -57.5 -43.5 84.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HB2' HD21 ' A' ' 43' ' ' LEU . 92.3 mt -84.72 -20.22 31.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.982 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -62.3 -36.6 82.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.357 0.598 . . . . 0.0 109.978 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 24.85 3.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.43 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -116.8 121.77 32.41 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.847 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.62 -32.63 93.56 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.274 2.649 . . . . 0.0 114.238 -174.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.463 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 6.1 p90 -99.24 23.27 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -131.16 120.34 23.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 111.453 175.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.551 HG13 HD13 ' A' ' 7' ' ' ILE . 71.4 mt -106.21 111.43 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.254 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.4 mp -91.8 169.14 10.94 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.8 m -152.67 128.74 10.39 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.89 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -89.1 135.87 33.33 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 0.0 110.271 177.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -101.52 -174.9 2.71 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.572 178.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.93 157.1 35.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.067 0.46 . . . . 0.0 110.71 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.431 HD22 ' C ' ' A' ' 48' ' ' ASN . 0.2 OUTLIER -79.5 -41.51 27.24 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.251 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.9 m120 64.29 -176.92 0.16 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.652 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -98.95 164.49 12.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 64.89 24.43 12.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.117 0.484 . . . . 0.0 110.402 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -66.77 -37.51 84.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.732 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -126.97 91.89 45.8 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.042 169.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.534 ' O ' HG23 ' A' ' 73' ' ' ILE . 7.0 Cg_exo -72.74 105.01 1.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 123.099 2.533 . . . . 0.0 112.182 -176.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.554 HD12 HG23 ' A' ' 94' ' ' ILE . 11.0 tp 178.32 26.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 121.951 0.881 . . . . 0.0 109.763 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.482 ' HA ' HD11 ' A' ' 98' ' ' ILE . 25.2 p-10 -142.48 38.22 1.52 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.567 -170.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 75.2 m-85 -96.64 165.64 12.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.945 0.402 . . . . 0.0 111.482 -175.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.524 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 14.3 m -64.37 138.17 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.194 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -51.28 -54.1 29.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.12 0.485 . . . . 0.0 109.774 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.4 t -59.34 -34.43 72.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.731 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' MET . 34.6 tt0 -71.79 -42.13 67.48 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.055 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 57' ' ' TYR . 80.8 mt -65.37 -40.9 94.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.325 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HG3' HG12 ' A' ' 91' ' ' ILE . 98.7 mttt -68.22 -17.17 64.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.033 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.54 11.14 42.64 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.237 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 45.9 mtt -89.13 162.19 16.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.0 111.528 -179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.739 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 45.6 t-20 -71.2 145.98 49.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.202 174.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 14.2 tmtt? -53.69 -39.35 65.08 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.603 177.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.99 -28.03 67.93 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.742 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.739 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 23.1 mm-40 -64.35 -50.16 68.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 74' ' ' ILE . 64.8 m-70 -55.45 -42.49 74.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.916 176.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.542 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 45.6 mt-10 -58.51 -51.56 69.34 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.388 0.43 . . . . 0.0 110.352 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m -55.03 -42.11 72.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.509 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.534 HG23 ' O ' ' A' ' 54' ' ' PRO . 88.2 mt -57.7 -60.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.509 178.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.707 HG12 ' O ' ' A' ' 70' ' ' HIS . 3.1 pt -76.24 -13.92 14.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -174.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.7 m -72.59 -45.22 60.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -74.39 -30.2 61.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.524 HD22 HD13 ' A' ' 55' ' ' ILE . 33.4 tp -67.63 -34.2 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.41 36.06 3.67 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.17 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.555 ' HB3' ' HB ' ' A' ' 74' ' ' ILE . 30.7 tpt180 -115.55 -50.92 2.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.573 0.225 . . . . 0.0 110.523 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.6 t30 68.08 134.12 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.452 0 O-C-N 124.028 0.83 . . . . 0.0 111.16 -177.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.542 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 20.4 Cg_endo -81.05 61.98 8.39 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.457 2.105 . . . . 0.0 112.506 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.7 p -86.42 -17.81 33.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.549 -179.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -149.77 81.76 1.39 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 110.607 175.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 81' ' ' PRO . 85.3 m-85 -142.27 108.57 5.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.15 174.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -102.67 -28.07 12.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.084 -175.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.594 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 84.0 m-20 -107.11 152.69 23.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.757 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.58 -37.65 73.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -55.16 -41.49 71.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.707 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.594 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 48.2 mm-40 -59.88 -45.42 92.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.171 177.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -62.53 -46.79 86.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 63' ' ' LYS . 1.9 mp -66.52 -40.38 86.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.421 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.15 -40.53 90.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.493 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -71.04 -37.3 72.55 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.851 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.554 HG23 HD12 ' A' ' 55' ' ' ILE . 64.1 mt -70.72 -37.95 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.552 179.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.467 HD13 HD12 ' A' ' 98' ' ' ILE . 3.9 mm? -71.98 -18.71 61.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.133 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -60.9 -43.73 98.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -69.95 -37.35 75.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.661 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.482 HD11 ' HA ' ' A' ' 56' ' ' ASN . 64.2 mt -64.34 -41.61 92.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.56 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -68.82 -37.08 78.97 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.606 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.2 -54.68 22.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.775 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -101.64 24.04 10.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 110.984 -173.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -102.8 -13.86 28.6 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.0 -178.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -82.96 91.17 7.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.629 0.728 . . . . 0.0 111.716 -176.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.5 mp -126.5 -89.01 0.56 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.07 174.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -88.56 -41.81 12.46 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.73 142.15 51.47 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 58.1 t60 60.23 47.29 9.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -174.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -56.96 137.79 55.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.078 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -76.25 3.4 10.88 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -171.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -171.53 128.73 0.67 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 38.6 p-80 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.214 -179.461 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.0 mtp . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 121.191 0.52 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.418 ' O ' ' HA ' ' A' ' 26' ' ' THR . 56.0 m-85 -111.34 130.15 55.77 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 25' ' ' GLN . 14.3 p -113.59 123.08 49.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.956 0.408 . . . . 0.0 110.823 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.98 135.06 49.19 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.136 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 28.7 ttpp -126.53 122.78 36.11 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.42 -178.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -63.95 117.4 6.96 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.745 HG13 ' HG3' ' A' ' 8' ' ' LYS . 33.7 pt -106.12 -27.21 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.593 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.745 ' HG3' HG13 ' A' ' 7' ' ' ILE . 29.9 mtpp -117.36 100.58 7.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.334 -177.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.8 -120.92 1.82 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.567 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.486 ' HG3' ' H ' ' A' ' 11' ' ' THR . 20.8 pttp -176.21 -56.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -174.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.486 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.5 p -142.21 119.22 11.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.206 -178.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -154.51 124.2 6.61 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.55 135.92 49.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.998 0.428 . . . . 0.0 110.631 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 35' ' ' LEU . 58.5 t -107.3 107.03 21.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.944 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.9 mtt 65.66 -75.25 0.05 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.972 0.795 . . . . 0.0 111.334 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -138.76 -3.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.82 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -101.15 115.32 42.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -91.05 112.14 23.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.155 -174.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.44 153.81 19.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.269 0.556 . . . . 0.0 111.322 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -131.79 150.98 51.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.427 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -57.91 111.65 1.23 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.769 0.319 . . . . 0.0 110.841 175.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.76 -8.66 43.35 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.543 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -104.3 119.39 53.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.809 0.338 . . . . 0.0 110.654 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.549 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 20.4 p -102.72 123.08 45.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.204 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 3' ' ' THR . 48.9 mt-30 -127.65 157.78 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.655 0.265 . . . . 0.0 111.134 -178.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 0.8 OUTLIER -71.83 128.81 36.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.605 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 34.1 m -123.95 145.84 49.14 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.684 178.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.553 ' HD2' HD12 ' A' ' 31' ' ' LEU . 26.0 Cg_exo -63.5 156.89 53.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.711 2.274 . . . . 0.0 111.356 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -53.94 -36.07 62.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.53 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.45 -44.68 95.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.553 HD12 ' HD2' ' A' ' 28' ' ' PRO . 76.4 mt -78.26 -26.81 47.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.764 0.316 . . . . 0.0 110.613 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -57.63 -48.33 79.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.391 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -77.1 -30.76 55.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.041 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -61.31 -46.15 91.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.107 176.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.418 HD21 HG21 ' A' ' 14' ' ' VAL . 82.8 mt -77.97 -19.55 54.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.247 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -65.53 -28.08 68.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.31 0.576 . . . . 0.0 110.079 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -90.64 10.64 24.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.951 176.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 46.0 m-80 -135.02 97.44 13.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.359 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -71.81 28.07 0.24 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.788 2.992 . . . . 0.0 114.904 -169.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.7 p90 -112.37 9.65 19.81 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.484 -0.487 . . . . 0.0 111.044 175.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.416 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 42.9 m-85 -123.64 140.99 52.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.342 171.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.8 tt -97.18 126.66 49.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 171.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.01 103.98 13.63 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.623 -174.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.9 m -106.26 125.04 50.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.417 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -105.44 106.27 16.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.339 0.59 . . . . 0.0 109.639 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -101.16 105.36 16.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.016 -172.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.2 mt -119.7 102.21 8.44 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.313 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -151.01 113.91 4.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.979 -177.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 50' ' ' GLN . 37.7 m-80 59.66 -161.5 0.27 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.626 174.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.43 ' H ' ' HB3' ' A' ' 49' ' ' ASN . 48.5 mt-30 -145.02 -60.85 0.36 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.502 -172.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -80.41 32.78 0.29 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.529 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -90.76 -13.15 34.53 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.99 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -148.72 96.08 3.87 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.483 ' O ' HG22 ' A' ' 55' ' ' ILE . 98.3 Cg_endo -88.26 169.03 6.23 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 123.07 2.513 . . . . 0.0 113.121 -176.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.517 HD11 ' HG3' ' A' ' 97' ' ' GLN . 7.2 tp 52.61 25.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.433 1.093 . . . . 0.0 111.738 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -157.02 92.66 1.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.988 -175.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -142.77 159.95 41.26 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 60' ' ' SER . 3.2 m -67.98 145.03 54.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.055 174.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.426 ' HB2' HD11 ' A' ' 95' ' ' LEU . 2.4 tm-20 -56.54 -31.64 64.34 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 171.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 58' ' ' THR . 14.9 m -60.05 -38.75 83.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.456 172.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.26 -36.25 24.69 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.21 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.0 mt -72.76 -16.86 61.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.41 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.594 ' HD2' HD13 ' A' ' 91' ' ' ILE . 0.6 OUTLIER -63.45 -36.03 82.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.453 176.663 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.43 -135.23 5.2 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.068 -176.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm 61.77 -166.88 0.21 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 122.896 0.478 . . . . 0.0 110.124 -173.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -106.26 162.2 13.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.453 ' HE2' ' HB2' ' A' ' 67' ' ' LYS . 3.5 mppt? -69.63 -33.44 72.63 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 121.343 -0.143 . . . . 0.0 110.73 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.37 -46.04 46.63 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.793 0.683 . . . . 0.0 112.394 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.6 mp0 -57.63 -55.99 27.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 110.068 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.537 ' HA ' HD12 ' A' ' 73' ' ' ILE . 25.4 m80 -55.58 -47.75 75.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.998 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.49 -50.97 70.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.424 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.4 m -56.93 -37.83 72.03 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.316 0.579 . . . . 0.0 110.825 -178.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.537 HD12 ' HA ' ' A' ' 70' ' ' HIS . 88.0 mt -60.8 -60.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.544 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -70.18 -29.04 38.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.113 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.508 ' HA ' ' OD1' ' A' ' 80' ' ' ASN . 13.6 p -67.17 -32.78 74.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.839 0.352 . . . . 0.0 110.659 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -87.46 -18.05 30.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.878 0.37 . . . . 0.0 110.942 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.8 -37.75 67.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.045 175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 126.25 -13.71 7.02 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.208 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.459 ' O ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -113.93 80.35 1.37 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.206 0.527 . . . . 0.0 110.244 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.508 ' OD1' ' HA ' ' A' ' 75' ' ' SER . 77.2 m-20 -52.64 139.72 39.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.101 178.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' ' HB2' ' A' ' 84' ' ' PHE . 61.1 Cg_endo -75.3 51.19 2.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.976 2.451 . . . . 0.0 113.006 -178.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.6 m -71.13 -51.06 27.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.874 0.369 . . . . 0.0 110.504 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -100.37 -6.22 26.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.122 0.486 . . . . 0.0 110.429 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 81' ' ' PRO . 97.2 m-85 -90.79 108.66 19.97 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -145.2 -39.21 0.25 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.137 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.75 139.96 57.84 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.562 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' ARG . . . -52.55 -52.89 52.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -74.63 -25.5 59.27 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.691 -174.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.84 -39.84 76.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.438 0.637 . . . . 0.0 109.978 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 87' ' ' ALA . 12.1 ttm180 -54.48 -54.2 44.07 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.417 174.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.594 HD13 ' HD2' ' A' ' 63' ' ' LYS . 47.4 mt -61.67 -42.66 95.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.685 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.11 74.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.867 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -65.45 -48.17 73.62 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.865 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.27 -34.91 72.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.511 -176.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' A' ' 59' ' ' GLU . 29.2 mt -65.7 -39.45 91.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.008 176.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -68.63 -17.34 64.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.199 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.517 ' HG3' HD11 ' A' ' 55' ' ' ILE . 29.8 mm-40 -73.43 -24.8 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 176.059 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -86.59 -47.19 16.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.348 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.3 -46.85 75.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.395 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -87.2 91.53 8.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.094 0.473 . . . . 0.0 110.053 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -147.76 -11.42 0.39 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.894 -178.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 118.57 75.36 0.49 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.779 177.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -75.85 94.79 3.39 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 172.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.8 tp -117.09 107.76 14.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.341 -174.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 106' ' ' HIS . 26.3 mt-10 -127.47 -35.43 2.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.94 174.215 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 105' ' ' GLU . 31.8 m-70 -111.2 120.55 42.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.262 -165.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' HB2' ' OXT' ' A' ' 111' ' ' HIS . 12.8 p-80 -81.37 168.94 17.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.759 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -85.02 -51.75 6.45 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.689 0.281 . . . . 0.0 111.013 -175.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -158.66 -83.12 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -90.78 -36.25 14.37 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.44 ' OXT' ' HB2' ' A' ' 107' ' ' HIS . 42.5 m80 . . . . . 0 C--O 1.245 0.822 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.589 167.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 N--CA 1.484 1.233 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -107.11 131.3 54.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.882 0.373 . . . . 0.0 110.221 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.401 ' CG2' ' HB3' ' A' ' 24' ' ' SER . 12.5 m -138.62 127.47 23.71 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.381 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.95 138.88 44.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HD3' ' OG ' ' A' ' 24' ' ' SER . 34.9 ttpt -129.79 116.51 18.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -65.9 124.96 23.91 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.728 HG13 ' HG3' ' A' ' 8' ' ' LYS . 18.7 pt -117.18 -38.31 2.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.369 . . . . 0.0 111.319 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.728 ' HG3' HG13 ' A' ' 7' ' ' ILE . 61.5 mtpt -100.67 90.66 4.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.058 0.456 . . . . 0.0 110.243 -177.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.43 -137.22 6.47 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.697 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 10' ' ' LYS . 46.0 mtpt -154.25 -55.62 0.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.1 m -149.88 131.86 15.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.058 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -143.21 123.68 13.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.1 -177.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -85.17 117.58 24.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.93 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.0 t -114.41 106.25 20.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 176.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.73 -91.37 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.845 -177.142 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.98 6.79 6.43 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.8 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.467 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.0 mp -108.89 129.74 62.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -98.61 105.81 18.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.97 0.414 . . . . 0.0 110.878 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -87.49 143.51 27.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.487 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -133.9 144.22 48.74 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.288 178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -50.02 119.32 3.5 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.628 0.58 . . . . 0.0 112.033 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 -4.67 63.48 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.591 -0.731 . . . . 0.0 113.266 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -106.74 114.15 45.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 117.112 0.456 . . . . 0.0 111.669 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.406 ' OG ' ' HD3' ' A' ' 5' ' ' LYS . 41.4 m -79.12 130.97 36.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.107 171.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -129.78 139.3 51.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.772 0.32 . . . . 0.0 110.76 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -72.62 108.61 5.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 m -109.37 154.68 42.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.175 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.531 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.2 Cg_exo -67.37 164.39 30.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.955 2.436 . . . . 0.0 111.866 174.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -58.01 -40.04 79.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.564 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.47 -48.91 73.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.463 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD12 ' HD2' ' A' ' 28' ' ' PRO . 59.1 mt -67.47 -27.37 66.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.171 -176.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -58.9 -48.38 81.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.847 0.356 . . . . 0.0 110.137 175.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.39 -37.36 63.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.749 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 80.5 t80 -55.82 -42.98 76.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.734 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.504 HD22 ' CE1' ' A' ' 41' ' ' PHE . 87.2 mt -85.75 -18.96 31.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.991 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -61.48 -30.86 70.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.347 0.594 . . . . 0.0 109.838 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -82.81 -0.52 48.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.745 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -121.23 114.43 31.98 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.897 0.379 . . . . 0.0 110.951 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -78.16 44.58 1.62 Allowed 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 123.149 2.566 . . . . 0.0 113.542 -173.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -105.16 -15.53 15.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 110.297 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.504 ' CE1' HD22 ' A' ' 35' ' ' LEU . 35.9 m-85 -123.08 153.45 39.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.402 -167.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.577 HG12 HD13 ' A' ' 7' ' ' ILE . 25.9 mm -101.57 108.61 23.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 162.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -90.02 118.64 29.72 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.278 0.561 . . . . 0.0 110.083 -177.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 m -100.87 116.29 32.39 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.211 -175.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -89.85 112.41 23.75 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -101.49 149.45 24.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.156 0.503 . . . . 0.0 111.052 -170.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 72.2 mt -73.96 131.92 41.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.638 -169.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -104.5 4.16 32.79 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 165.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -78.65 -12.5 60.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.007 -171.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' GLN . 14.5 pt20 -73.03 89.99 1.48 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.406 0.622 . . . . 0.0 110.879 -178.114 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -135.47 63.9 1.59 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.369 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.95 -27.93 61.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.344 177.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 57.84 84.62 0.2 Allowed Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.867 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.512 ' O ' HG22 ' A' ' 55' ' ' ILE . 84.6 Cg_endo -94.31 146.83 1.87 Allowed 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.948 2.432 . . . . 0.0 112.912 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.813 HG21 HD13 ' A' ' 77' ' ' LEU . 3.8 tp 59.41 23.75 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 115.305 -0.861 . . . . 0.0 113.049 169.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -136.64 38.49 2.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.211 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.479 ' HB2' HD21 ' A' ' 62' ' ' LEU . 68.6 m-85 -94.92 155.94 16.55 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.569 -178.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.573 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -57.53 127.01 29.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.748 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.748 ' HB3' ' HG ' ' A' ' 95' ' ' LEU . 1.9 pp20? -62.79 -26.19 68.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.142 0.496 . . . . 0.0 110.289 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 p -71.59 -30.73 66.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.948 174.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 30.3 mm-40 -79.49 -40.7 29.12 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.561 175.237 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD21 ' HB2' ' A' ' 57' ' ' TYR . 92.3 mt -62.96 -20.93 65.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.153 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.614 ' HD3' HD13 ' A' ' 91' ' ' ILE . 0.1 OUTLIER -64.69 -33.46 76.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.916 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.95 -24.04 13.9 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.536 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 24.1 mmt -53.89 138.51 36.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.919 0.39 . . . . 0.0 110.99 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -84.47 -174.79 5.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.298 0.57 . . . . 0.0 111.836 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 63.2 tttm -59.34 -54.41 47.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.421 -178.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.59 84.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.795 -174.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 73' ' ' ILE . 49.1 mt-10 -63.99 -51.46 64.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.517 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.561 ' O ' HG13 ' A' ' 74' ' ' ILE . 26.7 m-70 -55.31 -43.11 74.56 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.095 175.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.575 ' HG2' ' HG2' ' A' ' 81' ' ' PRO . 46.0 mt-10 -60.17 -45.23 93.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.963 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -65.21 -45.04 86.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.744 0.307 . . . . 0.0 110.475 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 69' ' ' GLU . 97.8 mt -55.37 -56.54 11.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.993 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.1 mt -75.02 -25.75 18.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.065 -172.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.9 m -71.56 -27.18 62.98 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.111 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -69.88 -33.25 71.97 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 171.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.813 HD13 HG21 ' A' ' 55' ' ' ILE . 42.3 tp -67.17 -37.64 84.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.182 173.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 123.03 22.4 2.4 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.877 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -146.74 126.09 13.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 111.217 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 17.2 m120 -80.09 137.6 53.18 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.122 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.575 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 8.7 Cg_endo -84.39 48.68 2.52 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.599 2.199 . . . . 0.0 112.237 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.1 p -85.95 -36.08 20.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.656 175.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -66.3 -35.56 80.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.128 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -96.03 108.65 21.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.302 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -94.45 -26.41 16.49 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.993 0.425 . . . . 0.0 110.783 -174.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.507 ' HB3' ' CD ' ' A' ' 89' ' ' GLU . 53.2 t30 -99.09 151.34 21.07 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.107 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -65.36 -32.68 74.44 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -177.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.38 -55.63 32.31 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.589 0.233 . . . . 0.0 111.386 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' CD ' ' HB3' ' A' ' 86' ' ' ASN . 1.1 pm0 -60.5 -34.25 73.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.284 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.429 ' O ' HG13 ' A' ' 94' ' ' ILE . 97.5 mtt180 -64.6 -44.24 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.429 177.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.614 HD13 ' HD3' ' A' ' 63' ' ' LYS . 80.7 mt -66.05 -44.87 91.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.127 177.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.33 96.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.5 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 49.2 t80 -64.4 -42.36 96.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.455 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -69.73 -40.79 79.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 0.0 110.134 177.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.748 ' HG ' ' HB3' ' A' ' 59' ' ' GLU . 0.5 OUTLIER -57.66 -46.1 84.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.813 -179.623 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -76.42 -3.84 39.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -174.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.673 ' HG3' HG12 ' A' ' 55' ' ' ILE . 76.3 mm-40 -80.17 -30.15 38.8 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.4 mt -74.72 -34.88 35.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.591 174.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.1 -42.33 60.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.779 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -104.73 71.82 1.0 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.393 0.616 . . . . 0.0 110.205 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -111.85 116.09 30.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.951 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.81 110.93 3.05 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.842 176.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -98.13 37.69 1.41 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.512 0.672 . . . . 0.0 109.544 177.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.543 HD13 ' HB3' ' A' ' 108' ' ' HIS . 57.9 mt -93.54 147.02 23.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.855 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.57 -64.16 1.35 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -174.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -102.86 71.23 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -172.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 41.0 m80 57.26 23.18 8.47 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.391 174.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.543 ' HB3' HD13 ' A' ' 104' ' ' LEU . 8.4 p80 59.01 157.84 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.791 1.236 . . . . 0.0 113.417 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 46.0 t60 -88.09 152.09 22.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.604 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -99.53 -80.66 0.47 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 . . . . . 0 C--O 1.242 0.672 0 CA-C-O 118.799 -0.619 . . . . 0.0 109.651 177.323 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 40.4 m-85 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 t -144.14 146.23 32.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.969 0.414 . . . . 0.0 110.604 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.54 145.68 51.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.389 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -134.78 129.62 34.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.915 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.784 HD22 ' H ' ' A' ' 9' ' ' GLY . 2.8 mt -64.09 117.8 7.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -177.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.494 HG21 ' HB ' ' A' ' 42' ' ' ILE . 42.5 pt -108.39 -28.51 2.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.15 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 40' ' ' TYR . 49.1 tptt -88.91 -34.33 16.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.11 -177.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.784 ' H ' HD22 ' A' ' 6' ' ' LEU . . . -105.13 -157.77 23.06 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.672 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 73.3 mmtt -139.9 -41.76 0.43 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.464 HG23 ' HG2' ' A' ' 20' ' ' ARG . 25.4 m -152.34 114.4 4.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.88 172.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CB ' HD11 ' A' ' 6' ' ' LEU . 29.6 t80 -136.31 139.14 42.39 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.685 0.278 . . . . 0.0 110.358 -172.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -106.95 112.39 25.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.962 0.411 . . . . 0.0 110.271 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 35' ' ' LEU . 78.8 t -102.09 104.34 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 45.2 ttm 65.71 -79.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.742 0.651 . . . . 0.0 110.668 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.38 10.92 2.74 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.1 mm -108.03 139.63 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 m -108.95 113.27 26.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.929 0.395 . . . . 0.0 111.137 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -107.4 148.86 28.56 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.239 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 11' ' ' THR . 31.2 mtp85 -133.01 143.29 49.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 175.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 9' ' ' GLY . . . -55.28 127.21 28.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.955 0.407 . . . . 0.0 111.317 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.83 -13.28 67.79 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.162 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -103.77 113.49 40.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.703 0.287 . . . . 0.0 110.842 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.3 m -85.53 136.3 33.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -138.05 134.32 34.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -70.39 130.55 42.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.52 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 34.0 m -126.74 155.43 75.14 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.881 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.543 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.2 Cg_exo -70.88 166.69 28.15 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.855 2.37 . . . . 0.0 111.469 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -56.7 -36.91 70.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -56.33 -51.16 69.27 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.035 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.543 HD12 ' HD2' ' A' ' 28' ' ' PRO . 83.0 mt -73.77 -30.11 62.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.044 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -59.16 -46.85 87.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.584 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -80.55 -27.2 37.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.33 -41.76 98.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 173.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 41' ' ' PHE . 79.4 mt -85.33 -8.21 58.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.605 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.431 ' HA ' HD11 ' A' ' 43' ' ' LEU . 15.4 t30 -72.12 -32.2 66.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 172.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -75.98 -39.03 56.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.728 172.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.601 ' HB3' ' HD1' ' A' ' 40' ' ' TYR . 33.1 m-80 -86.44 108.9 19.69 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.548 -175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.18 44.84 1.68 Allowed 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.072 2.514 . . . . 0.0 113.541 -174.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.601 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 63.0 m-85 -102.41 -16.65 16.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 110.951 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.497 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 64.4 m-85 -125.35 158.84 33.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.004 0.431 . . . . 0.0 111.61 -169.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.494 ' HB ' HG21 ' A' ' 7' ' ' ILE . 15.8 tt -97.05 131.64 43.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 165.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.431 HD11 ' HA ' ' A' ' 36' ' ' ASN . 69.8 mt -108.58 134.41 51.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.398 0.618 . . . . 0.0 111.091 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.7 m . . . . . 0 C--N 1.317 -0.81 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.69 -179.978 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' A' ' 76' ' ' ASN . 56.6 Cg_endo . . . . . 0 N--CA 1.454 -0.806 0 CA-C-O 121.022 0.343 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.758 HG12 HD22 ' A' ' 77' ' ' LEU . 8.5 tp -169.65 27.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 122.247 1.022 . . . . 0.0 109.438 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -160.54 109.43 1.67 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.016 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -142.07 174.84 10.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.497 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -64.17 129.43 39.94 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.3 pp20? -60.27 -31.32 70.11 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -62.02 -37.95 86.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.119 174.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -29.6 42.84 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 120.566 -0.453 . . . . 0.0 110.39 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 65' ' ' MET . 92.1 mt -79.9 -20.25 46.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.102 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 30.2 mmtp -68.04 -30.96 70.31 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.278 0.561 . . . . 0.0 109.962 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.49 26.17 13.77 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.621 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.595 ' HG3' ' HB2' ' A' ' 69' ' ' GLU . 44.0 tpp -104.29 135.48 45.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.703 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 5.6 m-20 -71.92 170.03 14.62 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.782 0.801 . . . . 0.0 112.958 -171.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -58.21 8.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.769 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.45 -24.66 65.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.916 0.389 . . . . 0.0 111.126 -175.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.703 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 8.7 mm-40 -65.04 -54.08 35.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.998 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.527 ' O ' HG13 ' A' ' 74' ' ' ILE . 44.0 m-70 -53.66 -40.66 66.08 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 176.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.97 -49.22 62.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.623 -176.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 p -61.08 -35.83 78.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.63 0.252 . . . . 0.0 110.874 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 69' ' ' GLU . 94.0 mt -55.7 -61.6 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.104 0.478 . . . . 0.0 110.91 175.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.63 ' HA ' HD13 ' A' ' 55' ' ' ILE . 5.7 mt -70.93 -21.38 22.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -173.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 57.9 m -67.7 -35.08 78.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.843 0.354 . . . . 0.0 110.237 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.562 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 17.9 m-80 -72.13 -28.32 63.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.406 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.758 HD22 HG12 ' A' ' 55' ' ' ILE . 42.0 tp -64.43 -34.86 79.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.349 172.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 19.43 10.5 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.924 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 159.64 20.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -95.23 107.16 30.49 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.852 0.358 . . . . 0.0 110.627 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.525 ' HB3' HD12 ' A' ' 74' ' ' ILE . 83.9 Cg_endo -82.91 12.78 2.83 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.333 . . . . 0.0 112.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.6 p -77.89 -25.74 48.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.24 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.77 -37.54 59.16 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.087 0.47 . . . . 0.0 109.879 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -81.98 108.59 15.6 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -105.29 -29.59 10.2 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -170.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -89.68 153.24 20.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.84 0.353 . . . . 0.0 110.601 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.8 91.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -54.64 -48.79 71.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.94 -50.51 73.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.409 0.623 . . . . 0.0 110.807 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -67.24 -39.94 86.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.016 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.403 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.3 mt -70.05 -44.24 78.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.681 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.02 -42.4 99.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 0.0 111.335 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.24 -40.55 96.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.51 -34.89 71.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 178.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.632 ' O ' HG22 ' A' ' 98' ' ' ILE . 53.3 mt -67.36 -23.7 65.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.567 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -30.18 71.3 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.318 176.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 55' ' ' ILE . 2.7 mp0 -88.27 -25.07 23.01 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.395 -178.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 95' ' ' LEU . 8.3 tp -70.47 -22.18 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 173.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.405 173.767 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 85.1 m -112.74 130.36 56.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.205 0.526 . . . . 0.0 111.314 -174.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -114.21 146.1 40.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.176 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.408 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 36.1 ttpt -133.97 129.62 36.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.387 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -67.78 118.94 11.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.677 HG13 ' HG3' ' A' ' 8' ' ' LYS . 38.4 pt -109.25 -25.66 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.591 -176.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.677 ' HG3' HG13 ' A' ' 7' ' ' ILE . 99.2 mttt -122.06 96.79 5.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 0.0 111.115 -177.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.22 -118.52 0.99 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.878 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 2.2 ttmp? -175.61 -58.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.469 HG22 ' HG2' ' A' ' 20' ' ' ARG . 4.0 p -141.26 118.11 11.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.28 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -136.35 133.41 36.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.918 0.389 . . . . 0.0 110.634 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -97.24 110.5 23.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.892 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.83 92.01 3.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 173.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 35.1 mtm 62.78 -86.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.688 -176.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -124.23 12.54 8.02 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.536 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.8 mp -120.46 125.3 73.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.734 0.267 . . . . 0.0 110.478 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.4 m -89.95 109.36 20.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.516 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.469 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 81.0 m-85 -92.83 131.2 38.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.995 176.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HG2' HG22 ' A' ' 11' ' ' THR . 80.7 mtt180 -114.79 143.72 44.63 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.22 115.03 2.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.184 178.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.16 -9.49 59.58 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.837 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.9 t -100.72 115.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.881 0.372 . . . . 0.0 110.969 -178.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m -84.95 136.32 33.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.308 176.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.415 ' C ' HG23 ' A' ' 3' ' ' THR . 97.4 mt-30 -141.08 128.21 20.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.208 -177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.5 m -72.72 127.13 31.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.821 0.343 . . . . 0.0 110.273 178.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 m -118.68 163.43 25.81 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.685 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.7 Cg_exo -69.09 155.76 67.16 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.445 2.096 . . . . 0.0 110.576 169.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -63.94 -24.24 67.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.565 0.221 . . . . 0.0 111.275 -175.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -55.21 -41.45 72.04 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.12 0.486 . . . . 0.0 110.275 171.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.9 mt -84.32 -21.93 30.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.84 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.19 -47.38 80.02 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.95 -36.64 75.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.506 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.86 -39.88 95.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.842 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.7 mt -85.15 -12.08 53.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 178.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -68.26 -33.54 74.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -73.96 -15.1 61.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.953 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -122.44 86.43 48.47 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -71.91 13.59 0.48 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.367 2.711 . . . . 0.0 114.611 -168.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.54 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 15.5 p90 -90.93 14.83 12.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.467 0.651 . . . . 0.0 110.515 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.471 ' CE1' HD22 ' A' ' 35' ' ' LEU . 88.8 m-85 -118.26 148.4 42.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.702 169.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.478 ' HB ' HG21 ' A' ' 7' ' ' ILE . 16.5 tt -97.45 129.88 46.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -107.34 114.63 28.79 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.234 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.6 m . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.64 -176.215 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.641 ' O ' HG23 ' A' ' 73' ' ' ILE . 94.8 Cg_endo . . . . . 0 C--O 1.225 -0.156 0 N-CA-C 113.071 0.373 . . . . 0.0 113.071 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tp -145.06 24.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 122.395 1.093 . . . . 0.0 108.084 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -144.66 94.42 2.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.876 -173.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB2' HD11 ' A' ' 62' ' ' LEU . 77.3 m-85 -141.51 160.6 39.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.235 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.524 HG22 ' H ' ' A' ' 60' ' ' SER . 9.4 m -65.45 126.52 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.005 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -64.61 -26.91 68.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.222 0.534 . . . . 0.0 109.642 177.845 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 58' ' ' THR . 9.2 m -68.72 -30.05 68.6 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.609 175.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 13.3 mm-40 -82.1 -44.21 16.82 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.948 0.404 . . . . 0.0 110.341 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 57' ' ' TYR . 88.1 mt -69.03 -12.69 61.91 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.549 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.7 OUTLIER -67.78 -53.61 25.82 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.472 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.67 57.96 1.89 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.734 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.435 ' HG3' ' HA ' ' A' ' 62' ' ' LEU . 12.0 mmt -120.0 -169.49 1.79 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.583 0.706 . . . . 0.0 111.42 -177.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.482 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 39.0 t30 -100.14 -166.35 1.32 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.829 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.482 ' H ' ' CG ' ' A' ' 66' ' ' ASN . 1.4 ttpm? -100.6 -36.98 8.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.767 0.317 . . . . 0.0 110.561 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.505 ' HA ' ' OE1' ' A' ' 71' ' ' GLU . . . -62.78 -36.45 83.14 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -74.7 -39.39 61.98 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.032 -176.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.539 ' HA ' HD12 ' A' ' 73' ' ' ILE . 64.6 m80 -56.1 -42.78 77.33 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 120.621 0.248 . . . . 0.0 110.814 172.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 42.0 mt-10 -60.72 -46.72 89.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.229 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 76' ' ' ASN . 22.8 m -67.77 -31.42 71.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.126 178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 54' ' ' PRO . 30.7 mt -58.44 -57.6 10.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.527 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -86.64 -11.83 11.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.97 -171.735 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 p -81.03 -34.57 32.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 72' ' ' SER . 4.4 t-20 -65.18 -34.58 78.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.608 0.718 . . . . 0.0 109.265 174.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.416 HD21 ' OE1' ' A' ' 97' ' ' GLN . 53.4 tp -63.25 -25.16 68.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.997 175.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.97 11.29 60.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.241 -177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.613 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 1.6 tpm_? -93.0 -35.57 13.2 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 122.9 -0.177 . . . . 0.0 110.832 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 38.3 t30 70.45 108.96 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.721 0.638 . . . . 0.0 111.055 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.558 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 2.9 Cg_exo -75.16 65.17 6.21 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.953 2.435 . . . . 0.0 112.943 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 t -92.37 -29.21 16.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.389 . . . . 0.0 110.631 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.29 -23.96 32.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.259 0.552 . . . . 0.0 111.131 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 59.5 m-85 -82.44 126.73 32.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.878 -172.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -108.76 -57.82 2.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.563 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -89.7 154.34 20.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.445 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -61.04 -30.82 70.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.648 0.261 . . . . 0.0 110.63 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.58 -54.29 39.51 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.311 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.41 -37.38 70.11 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.308 0.575 . . . . 0.0 110.634 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.3 mtt-85 -68.25 -45.74 72.38 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.422 -178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 87' ' ' ALA . 75.4 mt -65.13 -43.67 95.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.621 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.5 80.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.484 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -71.26 -43.42 67.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.209 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 90' ' ' ARG . 91.7 mt -59.45 -43.03 89.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.133 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.525 HD23 HD12 ' A' ' 98' ' ' ILE . 19.1 mt -57.52 -39.04 75.68 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.281 174.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -68.33 -27.58 66.4 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.001 -174.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.54 HE21 ' N ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -83.37 -19.56 35.87 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.69 178.425 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.525 HD12 HD23 ' A' ' 95' ' ' LEU . 71.0 mt -67.48 -42.06 86.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 170.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.684 174.839 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.518 ' O ' ' HA ' ' A' ' 26' ' ' THR . 76.3 m-85 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.495 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -104.69 122.27 45.31 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.963 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.65 133.0 56.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.1 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -132.35 133.97 44.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.237 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.567 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 2.8 mt -67.07 125.36 25.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.157 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.661 HG13 ' HG3' ' A' ' 8' ' ' LYS . 32.0 pt -111.64 -15.77 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.109 0.481 . . . . 0.0 110.676 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.661 ' HG3' HG13 ' A' ' 7' ' ' ILE . 67.5 mttm -130.14 134.0 47.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.298 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.96 -124.44 7.52 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.052 175.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -160.99 -59.64 0.05 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.975 0.416 . . . . 0.0 109.937 -171.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.498 HG23 ' HG2' ' A' ' 20' ' ' ARG . 32.6 m -153.08 121.15 6.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.278 -178.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -133.98 126.05 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -98.3 117.98 33.91 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.323 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.701 HG21 HD21 ' A' ' 35' ' ' LEU . 21.4 t -111.91 106.14 20.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.673 -178.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 38.1 tpp 71.38 -1.52 2.73 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.634 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.36 -29.0 3.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.65 -177.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.498 HD13 HD11 ' A' ' 31' ' ' LEU . 2.2 mp -82.44 119.93 32.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.0 m -90.01 114.79 26.71 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.078 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -100.08 143.18 30.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.015 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' A' ' 11' ' ' THR . 51.6 mtm180 -124.28 142.24 51.42 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -53.02 113.64 1.17 Allowed 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.426 0.454 . . . . 0.0 111.377 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.58 -13.99 27.5 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.927 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.1 t -104.69 111.31 33.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.964 0.382 . . . . 0.0 111.602 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.495 ' HB3' HG22 ' A' ' 3' ' ' THR . 20.1 m -79.43 137.03 37.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.586 173.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.22 151.83 44.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.518 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 7.6 p -82.97 124.01 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.187 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 21.3 m -118.37 154.34 52.06 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.927 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 27' ' ' VAL . 15.2 Cg_exo -73.56 173.51 13.75 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.773 2.982 . . . . 0.0 113.348 176.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -49.47 -46.6 48.27 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.667 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.8 mmtm -57.59 -53.8 54.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.095 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 45.5 mt -67.48 -33.88 76.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -175.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -59.69 -40.96 89.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -79.96 -38.37 32.45 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.417 0.627 . . . . 0.0 110.352 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -39.77 91.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.274 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.701 HD21 HG21 ' A' ' 14' ' ' VAL . 91.6 mt -85.06 -19.12 32.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.714 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -62.06 -32.41 72.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.75 175.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -85.7 3.09 42.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.908 176.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -131.17 94.76 26.59 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.78 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.3 34.48 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.452 2.768 . . . . 0.0 114.621 -169.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.538 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.2 p90 -112.5 8.88 19.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.678 0.751 . . . . 0.0 110.515 172.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.453 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 61.1 m-85 -115.01 148.14 39.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.369 168.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.596 ' HB ' HG21 ' A' ' 7' ' ' ILE . 11.2 tp -96.99 122.77 48.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.254 170.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.9 mt -105.01 114.91 29.39 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.862 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.9 m . . . . . 0 C--N 1.314 -0.935 0 CA-C-O 121.212 0.529 . . . . 0.0 110.512 -178.582 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.501 ' O ' HG22 ' A' ' 55' ' ' ILE . 5.4 Cg_exo . . . . . 0 N--CA 1.458 -0.579 0 CA-C-O 120.328 0.053 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.534 HG12 HD22 ' A' ' 77' ' ' LEU . 7.6 tp 54.35 26.15 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.315 1.046 . . . . 0.0 112.163 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -148.54 88.42 1.63 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.146 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -142.64 152.62 42.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.947 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 1.016 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.4 m -59.29 130.89 49.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.411 175.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 16.9 pt-20 -61.88 -35.27 77.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.135 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 p -66.57 -30.28 70.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 174.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 1.016 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 55.9 mm-40 -72.54 -39.55 67.41 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.61 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.536 HD23 ' SD ' ' A' ' 65' ' ' MET . 83.2 mt -74.86 -14.46 60.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.386 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 65.3 mmtt -65.12 -47.28 77.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.821 0.343 . . . . 0.0 110.649 177.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.31 53.94 1.8 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.494 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.536 ' SD ' HD23 ' A' ' 62' ' ' LEU . 95.7 mtp -138.09 162.01 35.29 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -94.87 168.54 10.74 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 20.6 pttp -74.28 -27.35 60.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -169.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.07 -49.48 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.2 mp0 -57.94 -51.49 69.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.707 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.505 ' O ' HG13 ' A' ' 74' ' ' ILE . 82.0 m-70 -49.89 -40.43 42.84 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.553 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 56.4 mt-10 -65.8 -45.33 82.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.209 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.7 p -74.09 -36.82 64.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.984 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.0 mt -55.09 -59.87 2.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 177.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.52 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 4.6 mt -76.84 -21.6 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -173.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 71' ' ' GLU . 19.3 t -64.43 -33.58 76.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -72.96 -37.32 67.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.175 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.534 HD22 HG12 ' A' ' 55' ' ' ILE . 45.6 tp -59.06 -38.51 79.56 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.434 175.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.41 -43.72 0.87 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.28 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -101.18 107.19 18.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.776 0.322 . . . . 0.0 110.883 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -69.89 124.4 90.57 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.553 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 42.3 Cg_endo -69.05 73.9 1.01 Allowed 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.609 2.206 . . . . 0.0 114.021 -172.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.4 t -104.04 -20.85 13.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.25 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -87.96 8.73 24.98 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.39 0.614 . . . . 0.0 110.174 175.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -119.08 122.83 42.99 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -87.0 -58.9 2.42 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.779 -173.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -92.24 -179.91 5.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 111.434 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.432 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -74.3 -36.59 63.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.679 -176.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -64.33 -38.03 89.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.262 -176.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -58.51 -39.54 80.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.472 ' O ' HG13 ' A' ' 94' ' ' ILE . 77.1 mtt85 -70.4 -40.42 73.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.756 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 87' ' ' ALA . 79.5 mt -63.37 -41.74 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.269 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.67 96.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.219 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -63.91 -38.42 91.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.325 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.478 HG12 HD12 ' A' ' 55' ' ' ILE . 65.8 mt -65.54 -47.52 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 177.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 98' ' ' ILE . 30.4 mt -60.58 -36.37 78.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.953 0.406 . . . . 0.0 111.65 178.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.6 ttpt -63.35 -32.25 73.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.319 -175.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.23 -28.71 47.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 0.0 110.786 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.502 HD12 HD23 ' A' ' 95' ' ' LEU . 63.9 mt -68.23 -40.31 82.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 109.685 175.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.1 t70 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.23 177.637 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.601 0.238 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.8 p -126.22 139.65 53.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.03 136.27 45.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.783 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 5.6 ptpp? -133.25 143.57 49.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.973 0.416 . . . . 0.0 110.775 177.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.691 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -70.76 140.56 51.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.503 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.535 HD13 HG13 ' A' ' 42' ' ' ILE . 43.1 pt -122.82 -43.93 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 67.8 mttm -94.89 94.09 7.83 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.038 0.447 . . . . 0.0 110.462 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.05 -116.04 0.98 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.103 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -179.03 -55.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.9 m -140.57 115.5 9.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.33 176.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -135.87 133.8 38.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 64.5 t30 -102.35 121.61 42.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.091 -176.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.6 t -108.55 106.64 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.214 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.5 mtt 64.48 -85.84 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.993 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -136.19 9.01 4.12 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 121.251 -0.499 . . . . 0.0 111.887 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.462 HD13 HD11 ' A' ' 31' ' ' LEU . 3.8 mp -118.59 112.76 39.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.6 m -88.56 122.94 32.56 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.039 0.447 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -103.36 143.8 32.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.471 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -120.11 146.04 46.33 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.829 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.691 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.53 115.49 2.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.304 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.65 -16.59 60.23 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.693 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -103.28 110.97 31.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.79 0.328 . . . . 0.0 110.208 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.783 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 20.3 m -82.77 136.52 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.253 0.549 . . . . 0.0 111.877 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -114.54 149.41 36.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.436 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -81.68 119.28 23.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 27.7 m -119.44 152.7 53.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.832 0.349 . . . . 0.0 111.574 -173.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.443 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.3 Cg_exo -71.51 177.38 6.84 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.134 2.556 . . . . 0.0 112.087 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.0 -39.51 86.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.469 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -59.37 -52.82 63.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.313 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.538 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 67.3 mt -68.14 -28.91 67.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.393 -175.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 76.8 t80 -60.87 -52.9 63.1 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 177.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -73.47 -31.36 63.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.342 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -61.41 -50.39 73.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.595 ' HB2' HD21 ' A' ' 43' ' ' LEU . 80.1 mt -81.41 -16.9 50.73 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.841 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 56.5 t30 -69.49 -29.54 67.21 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.301 0.572 . . . . 0.0 109.67 175.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.18 -20.85 37.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.568 177.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -94.51 111.35 53.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.433 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.76 29.7 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.262 2.642 . . . . 0.0 114.554 -168.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.513 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.1 p90 -129.21 19.34 5.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.295 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -130.87 136.91 49.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.535 HG13 HD13 ' A' ' 7' ' ' ILE . 4.0 mt -97.8 124.63 50.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.595 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.5 mp -122.07 131.12 53.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.357 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.317 -0.817 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.451 -179.982 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.628 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 57.2 Cg_endo . . . . . 0 N--CA 1.456 -0.718 0 N-CA-C 113.334 0.475 . . . . 0.0 113.334 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.628 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 10.9 tp 163.15 29.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 122.196 0.998 . . . . 0.0 108.569 177.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.525 ' HA ' HD13 ' A' ' 98' ' ' ILE . 27.3 t30 -158.33 89.48 0.98 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.092 -171.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -139.17 164.94 28.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.783 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 60' ' ' SER . 4.6 m -64.74 145.16 56.63 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 172.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -58.88 -37.56 76.86 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 174.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.417 ' H ' HG22 ' A' ' 58' ' ' THR . 16.5 m -63.68 -32.84 74.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.25 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -28.59 62.05 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.319 0.58 . . . . 0.0 110.378 177.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' HB3' HG12 ' A' ' 91' ' ' ILE . 91.4 mt -87.77 -18.82 28.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.259 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -71.06 -43.24 68.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.035 0.445 . . . . 0.0 110.527 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -2.0 90.28 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.922 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.706 ' HG3' ' HG3' ' A' ' 69' ' ' GLU . 49.9 ttm -88.58 131.87 34.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 122.523 0.329 . . . . 0.0 110.34 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.473 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 22.9 m-80 -81.29 175.01 10.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.815 0.34 . . . . 0.0 111.113 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.432 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 19.7 ptmt -67.73 -39.28 84.3 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.07 -53.14 61.43 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.455 -174.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.706 ' HG3' ' HG3' ' A' ' 65' ' ' MET . 3.9 pm0 -65.63 -45.88 81.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.89 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.557 ' O ' HG13 ' A' ' 74' ' ' ILE . 17.4 m-70 -44.53 -53.17 7.31 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.02 -42.63 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.46 -176.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.2 m -61.15 -40.69 94.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.848 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 69' ' ' GLU . 79.8 mt -59.21 -58.66 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.527 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.0 mt -70.8 -24.95 25.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.917 0.389 . . . . 0.0 111.13 -173.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.6 m -68.29 -30.18 69.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.785 0.326 . . . . 0.0 110.233 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -75.17 -26.13 58.84 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.384 175.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 74' ' ' ILE . 50.4 tp -63.02 -32.94 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.495 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.51 5.09 30.1 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.868 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -128.49 99.2 5.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -70.6 129.52 89.94 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.017 -173.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -83.98 43.89 1.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.037 2.492 . . . . 0.0 112.11 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.8 t -70.41 -30.16 66.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.153 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.19 -18.06 35.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 110.588 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -85.47 118.38 24.96 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -111.62 -19.18 12.6 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.86 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 3.5 m-20 -97.45 145.26 26.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.399 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.01 -33.5 75.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.16 -177.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.42 -39.67 77.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.474 ' CD ' ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp0 -60.65 -33.8 73.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.966 0.413 . . . . 0.0 110.274 175.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 71.6 mtt-85 -67.07 -40.6 87.05 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 62' ' ' LEU . 97.0 mt -63.15 -45.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.75 93.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.592 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -70.4 -39.43 74.51 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.635 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -67.79 -34.71 69.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 98' ' ' ILE . 12.8 mt -64.67 -28.62 69.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.887 177.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 96' ' ' LYS . 5.0 tmtm? -77.21 -28.24 53.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.017 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -6.73 58.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.002 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 56' ' ' ASN . 48.0 mm -57.02 -40.27 71.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.674 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 C--O 1.232 0.164 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.935 178.569 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.541 ' HB ' ' HB3' ' A' ' 24' ' ' SER . 17.5 p -108.5 131.67 54.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.026 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.79 148.62 28.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.155 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -147.13 132.43 18.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.2 -174.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 6' ' ' LEU . 2.6 mm? -65.31 125.53 25.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.777 175.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.885 HD12 ' HG3' ' A' ' 8' ' ' LYS . 2.7 pp -109.72 -4.63 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.416 0.626 . . . . 0.0 110.36 175.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.885 ' HG3' HD12 ' A' ' 7' ' ' ILE . 61.8 mttm -138.11 127.38 24.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.997 173.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.69 -128.73 8.44 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.311 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -172.68 -48.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.0 m -152.27 128.95 10.81 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -148.92 133.41 17.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.643 0.259 . . . . 0.0 110.741 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 26.2 t-20 -96.26 123.1 39.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.548 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.5 t -110.54 106.49 20.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.005 177.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 66.35 -74.22 0.06 Allowed 'General case' 0 N--CA 1.466 0.364 0 O-C-N 123.941 0.776 . . . . 0.0 111.363 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.01 -0.36 1.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.683 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.2 mp -113.0 121.01 64.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.7 m -92.93 105.54 17.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.788 0.328 . . . . 0.0 110.653 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -93.73 161.77 14.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.167 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -133.8 154.65 50.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.321 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.45 130.73 45.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.771 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.99 -5.54 84.98 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.688 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.9 t -111.38 107.66 23.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.745 0.307 . . . . 0.0 110.638 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.541 ' HB3' ' HB ' ' A' ' 3' ' ' THR . 13.0 m -85.53 111.62 20.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.396 178.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -111.93 143.66 42.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.138 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -67.83 128.0 34.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.19 157.42 51.03 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.576 -176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.537 ' HD2' HD12 ' A' ' 31' ' ' LEU . 20.5 Cg_exo -67.31 168.82 16.79 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.27 2.647 . . . . 0.0 112.263 175.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -56.48 -48.9 76.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.804 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -58.45 -47.99 82.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.231 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.537 HD12 ' HD2' ' A' ' 28' ' ' PRO . 42.2 mt -69.29 -27.46 65.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.842 -175.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -57.78 -50.47 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 110.605 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.24 -29.56 38.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.859 0.361 . . . . 0.0 110.558 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 65.5 t80 -63.64 -42.15 98.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.5 mt -82.83 -19.78 36.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -70.52 -23.6 62.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.67 0.747 . . . . 0.0 109.316 173.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -92.69 7.85 41.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.474 176.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -108.35 133.21 20.65 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.278 -177.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.12 -11.76 21.27 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.982 2.455 . . . . 0.0 114.832 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.431 ' CB ' ' HB2' ' A' ' 8' ' ' LYS . 6.9 p90 -118.62 23.71 11.32 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.235 -178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -129.23 119.37 23.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.94 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.614 HD12 HG21 ' A' ' 7' ' ' ILE . 14.4 mt -106.39 125.11 62.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 170.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.12 156.67 19.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--N 1.319 -0.731 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.21 -179.193 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo . . . . . 0 N--CA 1.45 -1.068 0 N-CA-C 114.209 0.811 . . . . 0.0 114.209 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.717 HD11 ' HA ' ' A' ' 94' ' ' ILE . 6.5 tp -178.7 78.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.061 0.934 . . . . 0.0 110.79 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.541 ' OD1' HG13 ' A' ' 98' ' ' ILE . 4.9 t30 -170.15 86.39 0.12 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.801 -176.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.54 ' HB2' HD11 ' A' ' 62' ' ' LEU . 94.4 m-85 -141.39 152.01 43.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.748 0.308 . . . . 0.0 110.925 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.685 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 4.4 m -73.61 143.83 46.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.338 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.545 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 7.0 pt-20 -67.36 -38.71 85.22 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.292 177.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 16.2 m -63.16 -27.58 69.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.291 0.567 . . . . 0.0 109.748 174.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.685 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 39.0 tt0 -78.77 -43.52 25.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.226 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.552 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 96.6 mt -79.26 -18.33 52.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.013 -178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -62.92 -31.42 72.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.787 0.327 . . . . 0.0 110.337 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -102.0 21.84 40.36 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.899 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 25.0 mmt -107.95 146.34 32.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.845 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.774 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 14.4 m120 -71.3 169.64 14.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 43.3 mtmt -60.41 -50.88 71.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.025 176.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.52 -29.11 67.65 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.659 0.6 . . . . 0.0 111.752 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.774 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 4.9 mm-40 -66.23 -46.38 77.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.705 0.764 . . . . 0.0 109.389 177.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.671 ' HE1' HD13 ' A' ' 91' ' ' ILE . 30.6 m-70 -63.09 -38.94 93.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.103 175.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 42.9 mt-10 -68.29 -34.61 76.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.629 -175.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.8 p -70.42 -34.6 72.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.226 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 69' ' ' GLU . 85.5 mt -58.32 -61.73 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.576 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -73.6 -13.52 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.4 p -79.49 -32.87 42.53 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.366 -0.534 . . . . 0.0 109.749 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -71.14 -29.45 65.25 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.165 0.507 . . . . 0.0 109.724 173.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.6 tp -73.23 -26.58 61.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.648 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.77 -6.14 67.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.255 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.591 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -73.11 -36.74 66.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.787 0.327 . . . . 0.0 110.199 -179.757 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' ARG . 45.9 m-80 72.38 137.64 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.171 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.488 ' HA ' HD12 ' A' ' 74' ' ' ILE . 6.1 Cg_endo -78.49 -4.18 13.96 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.695 2.263 . . . . 0.0 113.237 -175.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.44 -10.78 57.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.937 0.399 . . . . 0.0 111.464 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -82.72 -15.02 53.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.241 0.544 . . . . 0.0 110.504 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -119.24 146.68 45.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.754 -173.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.529 ' NZ ' ' HB3' ' A' ' 85' ' ' LYS . 5.4 ttpm? -108.76 -65.04 1.17 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 0.0 110.597 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -76.52 157.48 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.914 -176.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.677 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -63.29 -36.78 84.8 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.18 -49.05 67.47 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.281 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 85' ' ' LYS . 40.7 mt-10 -58.29 -37.75 75.65 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.355 0.598 . . . . 0.0 110.493 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -73.45 -34.03 65.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.613 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 87' ' ' ALA . 22.7 mm -63.4 -50.06 80.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 176.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.68 -45.17 81.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.043 -176.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' A' ' 79' ' ' ARG . 41.3 t80 -67.15 -47.61 70.52 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.457 -176.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.717 ' HA ' HD11 ' A' ' 55' ' ' ILE . 61.6 mt -67.32 -38.97 81.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.969 0.414 . . . . 0.0 110.211 -178.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.545 ' HA ' HG22 ' A' ' 98' ' ' ILE . 4.4 mm? -73.23 -16.71 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.459 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -74.35 -43.46 56.52 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.44 -25.81 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.968 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.545 HG22 ' HA ' ' A' ' 95' ' ' LEU . 14.1 tt -73.31 -14.7 16.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.529 0.68 . . . . 0.0 109.957 175.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.614 178.05 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 . . . . . 0 C--O 1.231 0.12 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.77 131.97 49.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.862 0.363 . . . . 0.0 110.823 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.77 134.26 52.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.429 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -136.65 124.85 23.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.575 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.488 HD23 ' CB ' ' A' ' 19' ' ' PHE . 2.7 mm? -67.57 141.04 56.95 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.28 0.562 . . . . 0.0 111.01 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.556 HG21 HG13 ' A' ' 42' ' ' ILE . 39.1 pt -121.33 -2.4 8.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.473 174.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 95.0 mttt -144.34 149.4 36.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.294 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.39 -28.77 10.1 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.279 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 80.7 tttt 73.78 -37.12 0.36 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.775 0.83 . . . . 0.0 111.504 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.9 m -151.77 123.57 8.0 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -138.88 139.93 38.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 110.387 -174.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -102.9 123.42 46.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.812 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -117.85 102.06 12.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.2 mtt 63.64 -87.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.058 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.17 0.2 6.51 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -105.31 125.33 60.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.8 m -95.65 117.34 30.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.838 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.561 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 95.8 m-85 -107.04 157.54 17.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.768 0.318 . . . . 0.0 110.914 -178.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 20' ' ' ARG . 25.9 mtt180 -124.8 156.3 38.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.835 174.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.441 ' CB ' ' HA ' ' A' ' 10' ' ' LYS . . . -71.88 127.91 34.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.817 0.341 . . . . 0.0 110.599 176.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.9 -4.04 78.1 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.234 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 56.8 t -110.99 108.54 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.778 0.323 . . . . 0.0 110.58 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.8 m -78.34 114.65 17.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.538 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.561 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 42.9 mt-30 -117.36 143.99 45.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 0.0 110.988 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.9 m -72.1 131.29 42.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.861 -175.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 m -136.99 154.98 76.46 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.55 ' HD2' HD12 ' A' ' 31' ' ' LEU . 12.9 Cg_exo -71.05 163.6 38.66 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 111.603 174.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -63.04 -26.78 69.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.465 -176.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -67.67 -36.26 80.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.715 0.293 . . . . 0.0 110.923 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.0 mt -81.1 -31.15 34.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 177.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.539 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 56.7 t80 -60.19 -40.56 90.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.565 174.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -71.16 -43.62 67.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.435 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.23 -40.98 87.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.52 -14.81 51.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.939 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -69.01 -28.8 66.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -86.04 1.76 49.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.087 175.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -121.49 94.49 48.55 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 110.475 -173.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.62 61.89 7.0 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 114.976 -168.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 1.0 OUTLIER -153.22 25.3 0.54 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.261 0.553 . . . . 0.0 110.34 166.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -123.98 139.98 53.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.389 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.556 HG13 HG21 ' A' ' 7' ' ' ILE . 11.8 mt -97.2 115.08 35.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 162.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 32.6 mt -99.75 110.14 22.54 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.218 -174.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.71 -175.801 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.427 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 80.5 Cg_endo . . . . . 0 N--CA 1.475 0.419 0 N-CA-C 114.246 0.825 . . . . 0.0 114.246 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.546 HG12 ' HG2' ' A' ' 97' ' ' GLN . 10.5 tp 179.87 29.98 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.017 0.913 . . . . 0.0 109.842 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -150.63 91.47 1.74 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.905 -173.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -142.74 153.47 43.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.672 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.585 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.6 m -62.44 143.1 57.48 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.699 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.86 -34.69 73.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -70.94 -28.78 64.74 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.615 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.585 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 14.2 mm-40 -71.98 -34.11 68.68 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.02 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.495 HD23 ' SD ' ' A' ' 65' ' ' MET . 95.8 mt -81.85 -20.4 39.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.253 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 32.0 mmtp -64.96 -28.13 69.31 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.076 0.465 . . . . 0.0 109.814 172.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.49 23.9 33.87 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.293 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.495 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -122.17 147.56 46.01 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.23 -176.37 4.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.832 0.348 . . . . 0.0 110.808 -178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 58.5 tttm -52.16 -44.14 64.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.195 -176.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.23 89.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.803 -174.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.7 OUTLIER -61.84 -50.02 73.96 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.702 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.507 ' O ' HG13 ' A' ' 74' ' ' ILE . 91.2 m-70 -50.56 -46.12 57.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.186 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.476 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 43.1 mt-10 -64.67 -51.27 63.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.74 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.7 t -57.16 -50.11 73.85 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.301 0.376 . . . . 0.0 111.436 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.1 mt -52.84 -61.07 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.638 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.734 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 2.1 mt -77.36 -18.87 14.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.509 -170.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.0 m -69.14 -31.03 69.42 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -72.55 -32.45 66.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.306 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.466 HD22 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -66.39 -38.82 88.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.39 173.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.1 -69.72 0.46 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.083 -0.58 . . . . 0.0 111.816 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.453 ' O ' HG22 ' A' ' 74' ' ' ILE . 39.0 ttm180 -80.27 102.79 9.71 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.429 ' HB2' ' HD2' ' A' ' 81' ' ' PRO . 30.7 p-10 -71.22 155.42 93.07 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.178 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.734 ' HD3' ' HB ' ' A' ' 74' ' ' ILE . 60.0 Cg_endo -73.67 36.76 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.105 2.537 . . . . 0.0 113.91 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.4 t -79.75 -29.86 40.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -71.56 -38.98 70.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.809 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -88.4 108.68 19.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.833 -178.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -71.81 -63.08 1.2 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.228 -172.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -72.11 150.55 43.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.937 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.44 -37.21 80.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.559 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -60.22 -39.21 85.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.907 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -62.55 -38.66 90.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.304 0.573 . . . . 0.0 110.406 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 34.4 mtt180 -68.76 -38.46 80.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.951 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.476 HG12 ' HE1' ' A' ' 70' ' ' HIS . 77.8 mt -65.24 -45.4 93.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.143 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.5 90.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.354 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.505 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.5 t80 -66.8 -36.77 83.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.823 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.1 mt -71.92 -46.09 61.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.389 . . . . 0.0 110.365 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 59' ' ' GLU . 3.7 mm? -65.14 -45.55 84.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.745 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -79.4 -5.4 54.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.369 -0.533 . . . . 0.0 110.472 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.546 ' HG2' HG12 ' A' ' 55' ' ' ILE . 6.0 tp-100 -70.94 -31.9 68.63 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 41.6 mt -65.9 -26.76 39.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.635 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.3 t70 . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.954 179.111 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 67.9 p -108.69 143.6 37.58 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.359 -175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.39 138.69 52.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.544 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -141.28 134.74 29.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.584 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 21' ' ' ALA . 3.8 mm? -61.64 123.91 19.22 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.814 0.34 . . . . 0.0 110.646 176.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.542 HG13 ' HD2' ' A' ' 8' ' ' LYS . 13.5 pt -100.65 -23.01 4.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.014 173.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.542 ' HD2' HG13 ' A' ' 7' ' ' ILE . 2.0 mptp? -132.6 122.31 24.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.099 171.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.82 -137.44 8.68 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.218 -0.991 . . . . 0.0 112.888 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.77 ' HG3' ' H ' ' A' ' 11' ' ' THR . 49.6 pttt -168.01 -68.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.77 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.6 p -132.14 118.38 19.53 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -129.77 111.74 12.93 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 45.3 t-20 -95.92 120.03 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.225 -177.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.481 HG21 HD21 ' A' ' 35' ' ' LEU . 50.5 t -119.13 104.49 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 0.0 110.682 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.2 mtt 62.95 20.14 12.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.124 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.11 -30.19 5.73 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.379 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.29 116.34 30.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.8 m -96.58 108.81 21.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 -177.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.406 ' HB2' ' CD2' ' A' ' 6' ' ' LEU . 37.5 m-85 -90.08 144.6 25.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.537 ' HG3' HG22 ' A' ' 11' ' ' THR . 10.1 mpt_? -117.06 149.13 40.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.561 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HA ' ' HB2' ' A' ' 6' ' ' LEU . . . -63.31 109.82 1.7 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.588 176.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.65 -1.78 39.27 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.193 -178.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.7 t -117.47 125.54 74.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.76 0.314 . . . . 0.0 110.516 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 m -100.04 123.49 44.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.518 178.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -118.79 150.69 39.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.71 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -92.78 126.65 37.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.213 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.9 m -124.46 157.42 65.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.195 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.57 ' HD2' HD12 ' A' ' 31' ' ' LEU . 38.3 Cg_exo -62.21 156.91 47.72 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.936 2.424 . . . . 0.0 110.974 171.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -68.08 -15.85 63.77 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -172.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -71.65 -43.03 66.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.423 . . . . 0.0 110.026 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.57 HD12 ' HD2' ' A' ' 28' ' ' PRO . 38.0 mt -73.74 -33.69 64.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.902 175.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.591 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 84.4 t80 -53.65 -53.95 44.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.708 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 37' ' ' GLU . 4.2 mm-40 -65.94 -36.7 84.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.581 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -62.45 -45.84 91.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 110.276 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.481 HD21 HG21 ' A' ' 14' ' ' VAL . 95.5 mt -74.08 -25.9 60.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.037 0.446 . . . . 0.0 110.602 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.02 -26.31 68.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.093 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 41.8 mt-10 -77.82 -11.29 59.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.319 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 35.4 m-80 -102.38 113.81 65.7 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.93 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 19.1 Cg_exo -66.85 -7.39 18.3 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 123.184 2.589 . . . . 0.0 114.546 -173.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -101.62 17.0 23.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.416 -0.513 . . . . 0.0 111.917 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -119.33 131.68 55.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.457 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' HG21 ' A' ' 7' ' ' ILE . 14.0 tt -97.19 117.39 41.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.685 0.755 . . . . 0.0 108.998 166.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.47 ' HA ' ' O ' ' A' ' 3' ' ' THR . 4.9 mp -107.07 115.59 30.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.828 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.3 m . . . . . 0 C--N 1.313 -0.986 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.368 -176.208 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.469 ' O ' HG22 ' A' ' 55' ' ' ILE . 96.1 Cg_endo . . . . . 0 N--CA 1.458 -0.615 0 CA-C-O 120.495 0.123 . . . . 0.0 112.387 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.702 HG12 HD22 ' A' ' 77' ' ' LEU . 7.0 tp 52.45 24.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 124.142 0.977 . . . . 0.0 111.766 178.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.536 ' OD1' HG12 ' A' ' 98' ' ' ILE . 7.9 t30 -153.1 83.51 1.2 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.128 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.24 152.45 50.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.113 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.736 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 24.3 m -57.23 138.27 54.9 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.375 0.422 . . . . 0.0 110.247 172.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 1.3 pt-20 -58.78 -30.43 67.55 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.712 ' H ' HG22 ' A' ' 58' ' ' THR . 15.1 m -69.2 -26.95 65.08 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.242 175.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.736 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 8.5 mm-40 -79.19 -44.49 21.78 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-O 121.061 0.458 . . . . 0.0 110.19 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.402 HD23 ' SD ' ' A' ' 65' ' ' MET . 57.9 mt -70.77 -20.63 62.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.455 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -65.12 -36.02 82.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.887 -177.195 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.08 42.16 1.96 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.719 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.402 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.6 mtt -117.53 166.37 12.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.032 0.444 . . . . 0.0 110.996 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.568 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 36.3 m-80 -83.51 162.36 20.93 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.293 174.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -67.21 -38.49 85.39 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.421 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.38 73.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.568 ' HG3' ' HB2' ' A' ' 66' ' ' ASN . 41.7 mt-10 -63.99 -49.89 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.479 ' HE1' HG12 ' A' ' 91' ' ' ILE . 34.4 m-70 -54.51 -44.46 72.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.022 173.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.3 mt-10 -57.81 -44.39 86.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.736 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.6 m -64.94 -45.56 85.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.945 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.0 mt -56.94 -59.71 2.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.347 0.594 . . . . 0.0 111.466 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 70' ' ' HIS . 5.2 mt -73.04 -21.49 19.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.036 -172.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.0 t -66.37 -36.46 82.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 175.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -69.51 -31.94 70.48 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.001 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.702 HD22 HG12 ' A' ' 55' ' ' ILE . 31.6 tp -63.1 -38.03 89.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.376 173.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.38 28.23 2.86 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.948 -177.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.515 ' HD2' ' OH ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -150.49 102.64 3.06 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 177.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -75.0 116.64 56.03 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.227 0.537 . . . . 0.0 110.269 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.52 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 96.0 Cg_endo -79.61 29.52 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 123.067 2.512 . . . . 0.0 112.738 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.96 -17.57 64.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.04 -27.25 30.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -82.43 109.05 16.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.733 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -71.73 -40.29 69.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.809 -174.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.538 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 19.2 m-80 -91.88 166.99 12.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.95 0.405 . . . . 0.0 110.148 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.527 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -85.77 -22.7 27.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.759 -178.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -63.0 -49.07 76.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.202 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.538 ' OE1' ' HB2' ' A' ' 86' ' ' ASN . 2.0 mp0 -58.57 -35.33 72.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.096 0.474 . . . . 0.0 110.615 177.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.0 mtt180 -66.14 -38.61 88.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.042 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 87' ' ' ALA . 77.0 mt -66.85 -45.06 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.008 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.23 99.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.427 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.515 ' OH ' ' HD2' ' A' ' 79' ' ' ARG . 64.3 t80 -65.95 -36.81 84.36 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.899 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' ARG . 77.5 mt -66.88 -36.4 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.147 177.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 98' ' ' ILE . 85.4 mt -62.57 -28.07 69.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.749 174.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 93' ' ' TYR . 37.7 ttmt -63.15 -30.41 71.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.548 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.67 -31.76 57.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.478 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.536 HG12 ' OD1' ' A' ' 56' ' ' ASN . 45.0 mt -66.2 -34.66 71.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.633 0.73 . . . . 0.0 109.805 174.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t70 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.407 177.012 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.549 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 63.8 m-85 . . . . . 0 N--CA 1.454 -0.259 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.9 p -111.09 122.88 49.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.01 0.433 . . . . 0.0 110.954 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.21 127.64 54.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.351 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -121.22 118.33 29.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.834 0.35 . . . . 0.0 110.724 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -66.92 126.84 30.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.557 HD13 HG13 ' A' ' 42' ' ' ILE . 26.4 pt -116.99 -33.06 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.862 0.363 . . . . 0.0 111.959 -175.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 61.2 tttp -111.97 102.52 10.74 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -176.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.86 -119.0 1.47 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.411 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -176.5 -65.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -173.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 m -137.78 123.21 19.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.7 177.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -127.64 146.82 50.42 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -175.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -119.44 117.26 27.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.606 0.241 . . . . 0.0 110.544 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -115.23 101.39 12.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.6 mtt 62.73 -86.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.31 178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.67 9.15 6.13 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.272 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.405 HD12 ' N ' ' A' ' 17' ' ' ILE . 4.4 mp -118.96 126.45 75.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.1 m -99.11 128.22 45.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.4 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -109.86 139.13 45.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.47 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.5 mtm-85 -116.49 142.43 46.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.17 117.3 3.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 111.623 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.87 0.34 55.12 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.765 -0.731 . . . . 0.0 113.045 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -109.55 116.44 52.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 111.005 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.6 m -83.2 106.75 15.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.728 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -109.84 139.42 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.525 -176.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -71.99 120.27 17.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.003 0.43 . . . . 0.0 110.533 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.8 m -112.98 158.32 38.16 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.339 -175.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 31' ' ' LEU . 34.0 Cg_exo -62.37 150.68 86.36 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.624 2.216 . . . . 0.0 111.293 172.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -59.12 -29.99 67.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.425 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.84 -44.6 85.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 0.0 110.693 176.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 34' ' ' TYR . 62.6 mt -76.07 -20.76 57.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.297 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.549 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 73.8 t80 -60.8 -47.86 84.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.895 0.379 . . . . 0.0 110.06 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -73.19 -35.36 66.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.058 0.456 . . . . 0.0 110.024 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 83.3 t80 -59.92 -29.83 68.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.746 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.4 mt -94.66 -16.26 23.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.003 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.32 -29.79 67.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.637 0.732 . . . . 0.0 109.821 177.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -90.6 7.46 39.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.253 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -115.18 106.64 50.92 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.611 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -76.58 40.67 0.8 Allowed 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.561 2.84 . . . . 0.0 115.337 -165.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.461 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 2.1 p90 -149.01 25.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 173.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.466 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 61.6 m-85 -127.06 138.61 53.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.226 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.557 HG13 HD13 ' A' ' 7' ' ' ILE . 46.8 mt -96.67 113.29 30.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.466 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 18.4 mt -100.32 107.79 19.67 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.763 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.443 -0.814 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.652 178.226 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo . . . . . 0 CA--C 1.531 0.346 0 N-CA-C 114.033 0.743 . . . . 0.0 114.033 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.662 HG12 HD13 ' A' ' 77' ' ' LEU . 10.2 tp -174.81 30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.899 0.856 . . . . 0.0 109.314 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -159.0 94.72 1.23 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.996 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -138.08 157.0 47.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.839 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.915 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.5 m -63.77 134.09 54.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 173.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 13.0 pt-20 -59.42 -33.45 71.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 p -69.22 -30.0 68.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.24 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.915 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 59.3 mm-40 -73.17 -37.25 66.61 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.635 176.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 97.6 mt -77.48 -15.34 59.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.581 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 27.4 mmtp -70.79 -37.24 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.753 0.311 . . . . 0.0 111.06 176.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.4 39.3 3.0 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.555 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 64.4 mtt -137.21 172.82 12.43 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.78 -157.51 0.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -68.62 -42.22 78.39 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.588 -175.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.62 62.78 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.8 mp0 -52.35 -55.88 18.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.971 0.415 . . . . 0.0 110.392 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.608 ' HE1' HG12 ' A' ' 91' ' ' ILE . 28.0 m-70 -58.96 -44.6 91.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.831 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 63.5 mt-10 -63.63 -41.46 98.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.772 -0.195 . . . . 0.0 111.108 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.1 p -65.34 -34.62 78.75 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.521 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 70' ' ' HIS . 96.6 mt -58.81 -57.59 10.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.962 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 70' ' ' HIS . 1.3 mt -72.55 -16.1 17.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.862 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 66.7 m -67.9 -36.51 80.33 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -66.44 -34.52 78.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.007 173.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.662 HD13 HG12 ' A' ' 55' ' ' ILE . 46.3 tp -63.59 -38.37 90.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.008 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 104.06 23.8 7.96 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.083 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.468 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 0.1 OUTLIER -131.66 126.23 34.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.727 0.298 . . . . 0.0 110.269 -178.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -73.89 136.51 76.77 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.888 178.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.481 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 5.0 Cg_exo -80.23 49.46 3.21 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.082 2.521 . . . . 0.0 111.329 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -49.75 -54.29 19.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.153 -170.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -106.27 24.73 12.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.338 0.589 . . . . 0.0 110.964 -174.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -107.61 120.27 41.76 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.466 ' HG2' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -115.56 -32.86 5.41 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.918 -175.02 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.58 169.59 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.548 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -72.98 -41.26 64.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.671 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.19 -44.8 88.23 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.632 0.582 . . . . 0.0 111.628 -177.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' A' ' 85' ' ' LYS . 33.3 mt-10 -58.09 -38.78 77.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 110.55 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.553 ' HD3' ' HB2' ' A' ' 70' ' ' HIS . 73.0 mtt85 -72.81 -32.04 65.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.711 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.608 HG12 ' HE1' ' A' ' 70' ' ' HIS . 75.8 mt -67.49 -47.15 81.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.15 -44.77 75.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.189 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.468 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 37.0 t80 -65.05 -40.51 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.92 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.489 ' O ' HG13 ' A' ' 98' ' ' ILE . 86.9 mt -67.52 -44.31 86.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.425 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.487 HD13 HD12 ' A' ' 98' ' ' ILE . 3.7 mm? -62.61 -41.37 98.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.292 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -65.32 -28.0 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 110.991 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -19.4 46.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.915 0.388 . . . . 0.0 110.39 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 94' ' ' ILE . 75.9 mt -74.27 -42.2 50.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 172.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.28 176.747 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 . . . . . 0 CA--C 1.516 -0.338 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -116.28 134.86 54.44 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -170.037 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.65 118.66 28.66 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 174.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 38.9 ttpt -119.11 126.4 51.54 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.835 0.35 . . . . 0.0 110.332 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.645 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -66.02 125.33 25.12 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.401 HG13 ' HG3' ' A' ' 8' ' ' LYS . 29.3 pt -111.9 -30.91 2.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.267 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 7' ' ' ILE . 64.2 mttp -127.89 111.53 13.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.781 0.324 . . . . 0.0 110.726 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.47 -13.29 3.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.658 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 61.5 mttp 71.39 -51.02 0.69 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.496 0.719 . . . . 0.0 111.922 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -150.35 129.45 12.69 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.741 0.305 . . . . 0.0 110.349 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -156.77 129.71 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 10.5 p30 -111.19 146.15 37.4 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.913 -177.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 HD21 ' A' ' 35' ' ' LEU . 44.6 t -127.93 99.25 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.274 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 61.9 mtm 57.74 49.55 12.1 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.855 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.49 -35.58 4.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.603 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.491 HD13 HD11 ' A' ' 31' ' ' LEU . 4.0 mp -80.24 108.76 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 29.2 m -91.44 126.77 36.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.017 -178.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 71.7 m-85 -108.03 146.04 33.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.81 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -133.87 154.88 50.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.688 0.28 . . . . 0.0 110.972 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.645 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -60.76 105.34 0.44 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.081 178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.74 11.17 47.89 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.688 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.67 108.21 24.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.887 0.375 . . . . 0.0 110.632 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.414 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 15.2 m -74.95 122.13 22.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.592 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -121.51 129.13 52.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.504 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.5 p -74.42 129.91 38.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.732 0.301 . . . . 0.0 110.351 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 29.5 m -120.73 153.4 56.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.468 -174.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.542 ' HD2' HD12 ' A' ' 31' ' ' LEU . 19.5 Cg_exo -67.12 164.99 28.03 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.714 2.276 . . . . 0.0 111.167 171.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.41 -29.99 70.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.858 0.361 . . . . 0.0 110.938 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -64.72 -50.16 68.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.713 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.542 HD12 ' HD2' ' A' ' 28' ' ' PRO . 45.2 mt -71.72 -29.41 64.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.503 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -55.44 -51.36 67.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.523 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 44.8 mt-10 -75.42 -31.25 60.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.98 0.419 . . . . 0.0 110.776 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -61.46 -33.36 73.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.303 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.536 HD22 ' CE1' ' A' ' 41' ' ' PHE . 93.2 mt -98.69 -12.61 20.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.982 177.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.559 ' HA ' HD11 ' A' ' 43' ' ' LEU . 5.8 t30 -61.22 -36.16 79.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.565 0.698 . . . . 0.0 109.882 173.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 37' ' ' GLU . 7.9 pt-20 -87.12 13.41 9.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.266 176.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.422 HD22 ' C ' ' A' ' 37' ' ' GLU . 0.9 OUTLIER -116.58 122.96 31.07 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.792 0.329 . . . . 0.0 110.352 177.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 96.3 Cg_endo -88.64 22.42 0.86 Allowed 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.992 2.461 . . . . 0.0 114.101 -174.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -127.58 21.49 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.188 0.518 . . . . 0.0 111.669 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CE1' HD22 ' A' ' 35' ' ' LEU . 73.9 m-85 -128.49 145.49 51.09 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.492 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.9 tt -97.33 124.32 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 171.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 36' ' ' ASN . 12.5 mt -100.84 108.37 20.15 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.141 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 3' ' ' THR . 20.8 m . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.818 -174.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.442 ' O ' HG22 ' A' ' 55' ' ' ILE . 20.0 Cg_exo . . . . . 0 N--CA 1.465 -0.185 0 N-CA-C 111.754 -0.133 . . . . 0.0 111.754 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.786 HG12 HD22 ' A' ' 77' ' ' LEU . 10.8 tp 49.02 25.61 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-O 121.915 0.864 . . . . 0.0 111.458 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -141.62 96.46 2.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.819 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.453 ' HB2' HD11 ' A' ' 62' ' ' LEU . 83.8 m-85 -140.6 161.91 36.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.709 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.644 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 1.1 m -61.88 133.58 55.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 60' ' ' SER . 0.6 OUTLIER -66.5 -32.95 74.63 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.969 -0.693 . . . . 0.0 109.706 -179.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.492 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 10.8 m -69.73 -24.83 63.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.223 0.535 . . . . 0.0 109.819 174.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.644 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 59.4 tt0 -81.66 -35.52 29.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.849 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 57' ' ' TYR . 96.3 mt -83.06 -6.32 59.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.718 175.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD2' HD13 ' A' ' 91' ' ' ILE . 15.5 tptt -66.25 -27.1 67.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.626 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.21 -119.01 4.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 173.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.459 ' HB3' ' H ' ' A' ' 66' ' ' ASN . 24.2 mmt 59.74 -158.17 0.32 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.423 0.63 . . . . 0.0 111.927 174.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.762 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 42.9 t-20 -123.64 158.66 31.03 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.96 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -67.27 -36.36 81.4 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 71' ' ' GLU . . . -61.85 -32.77 73.14 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.131 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.762 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 12.5 mm-40 -62.66 -56.67 15.62 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.671 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.8 m80 -51.45 -40.61 59.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.963 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 45.1 mm-40 -51.84 -64.99 0.64 Allowed 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.302 0.376 . . . . 0.0 110.549 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.8 m -56.91 -44.47 82.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.216 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.2 mt -53.28 -57.22 5.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.648 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.671 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.2 mt -82.05 -20.96 10.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.753 -172.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.51 -33.38 74.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -73.38 -27.76 61.65 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.786 HD22 HG12 ' A' ' 55' ' ' ILE . 56.7 tp -65.89 -29.75 70.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.97 0.414 . . . . 0.0 110.173 172.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.84 9.38 26.56 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.466 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -133.47 97.82 4.05 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.461 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 14.5 m120 -68.42 131.8 91.59 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.698 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 80' ' ' ASN . 57.1 Cg_endo -88.92 65.39 2.75 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.924 2.416 . . . . 0.0 112.379 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.1 t -86.36 -31.7 21.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.471 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -90.05 -25.01 21.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.937 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -82.32 108.65 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -92.69 -61.92 1.5 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.52 -168.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -72.81 163.72 27.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.04 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -63.64 -45.73 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.52 -174.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.526 ' HA ' HD12 ' A' ' 91' ' ' ILE . 10.3 t70 -65.97 -32.27 73.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.077 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.37 -44.0 96.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.544 0.688 . . . . 0.0 110.074 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -68.57 -34.83 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.24 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 88' ' ' ASP . 86.3 mt -65.8 -41.51 90.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.12 176.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.34 83.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.71 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -63.33 -44.76 93.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.623 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.485 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.0 mt -61.33 -45.56 98.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.206 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -47.95 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.562 -177.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.0 mttp -67.13 -20.87 65.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.476 HE21 ' HB3' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -80.16 -40.49 27.2 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 94' ' ' ILE . 83.4 mt -63.74 -35.32 72.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.456 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.8 t70 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.199 -179.768 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 . . . . . 0 C--O 1.232 0.179 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.641 ' OG1' ' HB ' ' A' ' 44' ' ' THR . 73.9 p -131.59 155.48 47.44 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.686 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -126.84 137.8 53.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.224 177.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HB2' ' OG ' ' A' ' 24' ' ' SER . 5.8 ttpm? -120.73 116.97 26.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.104 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.602 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -67.99 124.28 22.95 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.582 HG13 ' N ' ' A' ' 8' ' ' LYS . 18.9 pt -117.61 -36.67 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.909 0.385 . . . . 0.0 111.695 -177.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.582 ' N ' HG13 ' A' ' 7' ' ' ILE . 44.9 tttm -92.06 30.56 1.4 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.747 -167.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.1 -126.7 0.85 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.62 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -160.13 -44.45 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.7 m -152.99 125.01 7.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.989 174.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -140.01 117.55 11.49 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.2 t-20 -91.22 115.87 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.3 t -106.38 97.29 5.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.726 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 62.8 mtt 59.39 22.65 11.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.931 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 121.6 -33.75 4.18 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.578 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.9 mm -78.32 108.79 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.3 m -91.06 101.22 13.97 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.702 0.286 . . . . 0.0 110.759 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 98.4 m-85 -86.06 144.37 27.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.587 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -124.97 143.26 50.98 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -51.71 118.27 3.26 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.67 4.03 59.33 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.768 -0.651 . . . . 0.0 113.224 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.5 t -117.75 112.1 37.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 117.024 0.412 . . . . 0.0 111.523 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 71.5 m -74.45 116.47 15.16 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.896 171.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.5 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 25.6 mt-30 -116.3 146.78 42.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.498 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.533 ' HA ' HG22 ' A' ' 3' ' ' THR . 13.0 p -67.51 131.81 46.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.127 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 35.6 m -134.7 144.83 52.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.922 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.557 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.7 Cg_exo -66.96 161.77 41.0 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.627 2.218 . . . . 0.0 110.883 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -59.02 -31.53 68.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.613 0.245 . . . . 0.0 111.469 -176.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.51 -48.49 79.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.862 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.557 HD12 ' HD2' ' A' ' 28' ' ' PRO . 68.9 mt -73.4 -29.01 62.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.667 0.27 . . . . 0.0 110.537 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -55.6 -48.95 74.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.962 174.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -71.56 -34.87 70.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.309 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 66.8 t80 -64.94 -40.84 95.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.595 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.498 HD22 ' CE1' ' A' ' 41' ' ' PHE . 73.6 mt -81.93 -20.13 39.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.741 0.305 . . . . 0.0 110.629 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -66.32 -26.05 67.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.679 0.752 . . . . 0.0 109.051 169.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB3' ' O ' ' A' ' 34' ' ' TYR . 13.7 tp10 -79.4 -15.42 57.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.929 176.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 40' ' ' TYR . 40.4 m-80 -115.14 113.18 43.85 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.532 -174.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 2.8 Cg_exo -75.32 41.34 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.016 2.477 . . . . 0.0 114.105 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 38' ' ' ASN . 9.1 m-85 -111.75 -6.26 14.34 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.926 0.393 . . . . 0.0 110.001 176.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.498 ' CE1' HD22 ' A' ' 35' ' ' LEU . 78.7 m-85 -124.41 141.79 51.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.783 -169.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.553 HG13 HD13 ' A' ' 7' ' ' ILE . 68.9 mt -110.57 111.25 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 164.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 6.3 mp -82.91 148.52 27.63 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 120.955 0.407 . . . . 0.0 111.193 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.641 ' HB ' ' OG1' ' A' ' 3' ' ' THR . 17.7 m . . . . . 0 C--N 1.318 -0.794 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.675 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.487 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 2.7 Cg_exo . . . . . 0 N--CA 1.461 -0.44 0 CA-C-O 120.763 0.235 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.459 HG12 HD13 ' A' ' 77' ' ' LEU . 10.4 tp -171.33 21.2 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 122.46 1.124 . . . . 0.0 108.998 174.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -153.29 100.17 2.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.901 -175.071 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.425 ' HB2' HD11 ' A' ' 62' ' ' LEU . 90.9 m-85 -142.66 177.83 8.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.316 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.642 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -76.76 133.37 39.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.928 177.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 63' ' ' LYS . 4.2 pt-20 -66.97 -33.01 74.65 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.46 -178.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 11.5 p -74.28 -22.71 59.17 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.642 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 53.9 tt0 -80.19 -40.58 26.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.452 176.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 81.0 mt -75.85 -9.98 59.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.746 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' A' ' 59' ' ' GLU . 7.6 tppt? -66.39 -19.84 65.91 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.13 -113.23 2.11 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.52 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.7 mtt 62.13 -175.4 0.14 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.53 0.681 . . . . 0.0 111.562 -177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.682 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 46.4 t30 -95.49 151.41 19.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.279 174.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 51.8 mtmt -54.1 -48.24 70.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.805 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.4 -30.39 64.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.088 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.682 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 7.0 mm-40 -63.67 -52.02 62.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 73' ' ' ILE . 77.7 m-70 -55.79 -44.21 77.57 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.49 -43.45 97.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.611 -177.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -64.19 -40.61 96.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.757 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.4 mt -51.99 -62.15 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.13 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.4 OUTLIER -76.45 -16.93 15.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.935 -174.035 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.0 t -66.34 -35.2 79.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -32.02 60.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.353 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.459 HD13 HG12 ' A' ' 55' ' ' ILE . 47.1 tp -63.51 -36.21 83.03 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.151 0.5 . . . . 0.0 110.404 174.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.9 5.3 33.41 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.112 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.13 119.5 39.48 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -63.07 122.57 75.99 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.053 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.72 -3.33 11.76 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.189 2.592 . . . . 0.0 111.926 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.0 m -68.34 -12.2 60.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.965 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.97 -34.37 71.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.188 0.518 . . . . 0.0 110.559 175.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.628 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . 57.8 m-85 -100.23 122.75 43.53 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.95 -171.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -82.33 -40.19 21.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.304 -178.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.87 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 94.6 m-20 -96.38 162.16 13.61 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.047 0.451 . . . . 0.0 111.597 -176.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.453 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -70.62 -36.08 73.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.54 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -63.92 -36.86 85.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.428 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.87 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 21.1 mm-40 -59.45 -40.37 86.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.368 0.604 . . . . 0.0 109.75 176.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.9 mtt85 -63.81 -49.14 74.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.619 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 87' ' ' ALA . 61.8 mt -60.08 -42.85 91.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.171 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.19 77.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.379 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -78.05 -41.15 36.42 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.519 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.551 ' O ' HG13 ' A' ' 98' ' ' ILE . 70.1 mt -62.49 -44.67 99.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.55 ' HA ' HD12 ' A' ' 98' ' ' ILE . 14.9 mt -62.23 -29.23 70.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.625 176.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.471 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 3.9 ttmp? -61.84 -42.37 98.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.775 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -81.1 -20.12 42.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 94' ' ' ILE . 96.6 mt -71.75 -44.27 68.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.127 0.489 . . . . 0.0 110.09 176.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.372 179.283 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.472 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 70.3 m-85 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 120.728 0.299 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -131.69 135.47 46.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.026 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.17 122.51 47.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.183 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.531 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 88.6 tttt -109.01 107.23 17.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.421 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.633 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -65.84 122.3 17.01 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.545 HD13 HG13 ' A' ' 42' ' ' ILE . 43.2 pt -113.78 -24.14 3.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -178.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -102.59 105.16 15.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -176.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 116.58 -129.84 8.65 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.474 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 97.9 mttt -154.68 -46.18 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.9 p -136.21 153.82 51.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.645 172.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -162.41 116.45 1.79 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.757 0.313 . . . . 0.0 110.159 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.6 t-20 -90.76 112.31 24.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -178.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 HD21 ' A' ' 35' ' ' LEU . 54.9 t -104.2 108.69 25.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.793 177.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 65.41 -75.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.795 0.684 . . . . 0.0 111.364 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.85 6.19 1.81 Allowed Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.607 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.2 mp -115.84 119.39 61.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 22.2 m -92.83 105.7 17.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.972 0.415 . . . . 0.0 110.585 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -84.64 161.82 19.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.414 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 62.6 mtt180 -133.66 136.99 45.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.446 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.633 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.29 109.49 0.55 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.817 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.17 -7.55 30.85 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.516 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.6 t -111.21 127.2 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -179.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 12.1 p -102.95 104.21 14.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.42 177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -102.02 149.83 23.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 0.0 110.819 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -73.52 132.74 43.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.814 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.8 m -126.9 155.35 75.69 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.328 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -64.26 151.93 83.39 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.692 2.261 . . . . 0.0 110.962 172.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' H ' ' HG3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -64.75 -20.78 66.54 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -68.5 -45.86 71.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.354 0.597 . . . . 0.0 110.228 174.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 77.7 mt -75.18 -26.22 58.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.499 -179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.472 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 84.9 t80 -57.32 -50.76 71.93 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.327 177.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 8.0 mm-40 -70.86 -33.43 70.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.131 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -62.31 -46.14 90.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 110.656 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.516 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.9 mt -79.24 -19.46 50.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.058 0.456 . . . . 0.0 110.344 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 33' ' ' GLU . 32.7 t30 -62.97 -31.87 73.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.798 174.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.48 -1.12 55.22 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.877 176.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -123.48 117.72 27.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 111.682 -174.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.57 39.47 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 123.293 2.662 . . . . 0.0 113.851 -175.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.446 ' HB2' ' CD1' ' A' ' 41' ' ' PHE . 72.4 m-85 -98.38 -18.44 18.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.066 0.46 . . . . 0.0 110.208 176.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.516 ' CE1' HD22 ' A' ' 35' ' ' LEU . 68.3 m-85 -127.35 147.24 50.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.778 -169.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.545 HG13 HD13 ' A' ' 7' ' ' ILE . 60.0 mt -97.71 103.72 15.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 162.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.44 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.3 mp -87.06 131.24 34.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.608 -174.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.2 m . . . . . 0 C--N 1.318 -0.766 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.613 -177.792 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo . . . . . 0 N--CA 1.461 -0.404 0 N-CA-C 111.154 -0.364 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.683 HG21 HD13 ' A' ' 77' ' ' LEU . 11.2 tp -174.89 31.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 122.418 1.104 . . . . 0.0 108.397 -178.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -149.57 96.57 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.91 -173.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -142.72 165.67 26.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.537 -176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.403 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 21.6 m -64.9 129.81 41.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.353 175.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.4 pm0 -61.77 -38.59 88.59 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 179.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.8 m -62.26 -30.97 71.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.403 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 36.5 tt0 -78.44 -35.0 47.46 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.348 0.594 . . . . 0.0 109.83 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.7 mt -77.64 -14.8 59.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.97 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 70.8 mmtt -66.06 -27.73 68.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 65' ' ' MET . . . -97.72 -148.52 23.96 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 169.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.473 ' HG3' ' OE1' ' A' ' 69' ' ' GLU . 43.6 ttm 68.75 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.106 0.479 . . . . 0.0 111.128 175.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -73.5 163.28 28.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.536 . . . . 0.0 111.153 -174.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -56.83 -41.41 77.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.156 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.36 90.87 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.221 0.326 . . . . 0.0 111.38 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.473 ' OE1' ' HG3' ' A' ' 65' ' ' MET . 47.7 mt-10 -60.1 -56.31 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.429 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.635 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.7 m-70 -51.11 -42.22 60.52 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.212 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 38.7 mt-10 -68.59 -41.52 79.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.748 -177.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 27.2 t -63.34 -41.64 98.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 69' ' ' GLU . 76.0 mt -52.95 -58.86 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.403 176.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.635 HG13 ' O ' ' A' ' 70' ' ' HIS . 7.2 mt -72.28 -24.25 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.528 -173.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.53 ' HA ' ' O ' ' A' ' 79' ' ' ARG . 49.9 m -74.94 -33.12 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.987 0.423 . . . . 0.0 110.008 175.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.1 -31.05 71.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.228 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.683 HD13 HG21 ' A' ' 55' ' ' ILE . 35.4 tp -61.62 -29.44 70.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.002 174.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 118.72 -7.07 13.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.934 -0.651 . . . . 0.0 111.507 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 mmt180 -90.49 -172.78 3.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.699 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 3.9 t-20 -150.8 109.29 3.09 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.68 178.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.54 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 5.2 Cg_exo -77.79 54.0 4.63 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 123.218 2.612 . . . . 0.0 112.896 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.0 p -83.61 -37.32 23.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.22 0.533 . . . . 0.0 110.568 177.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -93.94 7.32 45.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.447 0.641 . . . . 0.0 110.48 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -105.5 108.53 20.1 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -97.42 -45.05 6.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -171.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.541 ' HB2' ' HG3' ' A' ' 89' ' ' GLU . 39.2 m-80 -80.53 168.01 19.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.234 0.54 . . . . 0.0 111.541 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 90' ' ' ARG . . . -81.05 -36.92 29.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.507 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.539 ' HA ' HD12 ' A' ' 91' ' ' ILE . 18.5 t70 -70.94 -32.77 69.75 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.863 -178.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.541 ' HG3' ' HB2' ' A' ' 86' ' ' ASN . 50.8 mt-10 -59.5 -46.33 89.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 110.748 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 18.2 ptp180 -71.3 -27.55 63.49 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.528 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 88' ' ' ASP . 96.6 mt -65.43 -45.95 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.89 -42.81 80.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.769 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.418 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 42.3 t80 -68.22 -39.15 82.43 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.793 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 55' ' ' ILE . 70.5 mt -66.04 -37.97 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.899 0.381 . . . . 0.0 110.283 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 98' ' ' ILE . 13.3 mt -65.29 -37.5 87.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.402 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.9 tmtm? -59.06 -31.15 68.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.939 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.616 ' HG3' ' CG1' ' A' ' 55' ' ' ILE . 7.5 mm-40 -74.27 -30.94 62.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.487 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.507 HD12 HD23 ' A' ' 95' ' ' LEU . 56.0 mt -67.65 -28.16 40.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.373 177.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.96 0.409 . . . . 0.0 110.538 176.845 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 90.0 m-85 . . . . . 0 CA--C 1.52 -0.19 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -106.79 131.7 53.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.789 -177.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.47 137.28 53.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.172 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -139.59 137.91 35.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.757 0.313 . . . . 0.0 111.08 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -65.11 118.58 9.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.653 174.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.591 HG21 ' HB ' ' A' ' 42' ' ' ILE . 36.3 pt -100.26 -6.34 9.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.502 0.667 . . . . 0.0 109.796 175.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.6 tttp -140.19 130.79 25.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.483 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 109.12 -132.82 11.29 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.315 -0.945 . . . . 0.0 112.42 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -164.32 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.618 0.247 . . . . 0.0 110.364 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.514 HG22 ' HG2' ' A' ' 20' ' ' ARG . 12.4 p -145.16 134.99 23.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.238 179.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -147.18 128.07 14.44 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -97.5 107.86 20.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.793 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 35' ' ' LEU . 61.6 t -96.55 95.16 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.1 mtt 65.7 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.099 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -133.56 -1.87 3.73 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.938 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -102.06 113.81 39.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.5 m -87.99 116.55 26.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.733 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -98.59 151.09 21.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.735 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HG2' HG22 ' A' ' 11' ' ' THR . 15.5 mtp180 -132.32 137.84 47.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 109.9 1.02 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.028 0.442 . . . . 0.0 111.037 177.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.2 -3.32 28.32 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.308 -178.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -118.81 113.84 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.831 0.348 . . . . 0.0 111.026 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 3' ' ' THR . 33.6 m -85.09 126.05 33.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.262 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -129.17 151.48 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.37 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 1.2 p -80.92 138.59 36.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.855 0.359 . . . . 0.0 111.806 -176.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.9 153.4 81.7 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.959 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 7.6 Cg_exo -74.29 171.39 18.14 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 123.05 2.5 . . . . 0.0 112.264 175.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -51.9 -46.76 64.71 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.968 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.19 -45.34 94.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.411 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.8 mt -73.12 -28.93 62.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -58.44 -47.01 85.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -68.11 -41.29 81.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.575 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.98 -45.56 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.845 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 14' ' ' VAL . 87.2 mt -76.83 -23.44 52.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.84 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.69 -29.59 70.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.362 0.601 . . . . 0.0 109.705 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -78.07 -6.69 55.41 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 38.1 m-80 -118.87 101.5 50.23 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.61 -177.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 14.2 Cg_exo -69.42 11.66 0.35 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.523 2.816 . . . . 0.0 114.735 -171.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.552 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 17.7 p90 -105.18 10.57 33.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.258 0.552 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.443 ' CE2' HD22 ' A' ' 35' ' ' LEU . 45.1 m-85 -117.07 136.29 53.09 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.885 172.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.591 ' HB ' HG21 ' A' ' 7' ' ' ILE . 9.9 tt -97.25 133.5 38.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 167.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mp -120.79 141.56 50.4 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.162 0.506 . . . . 0.0 110.554 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.314 -0.944 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.586 179.807 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.45 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 74.4 Cg_endo . . . . . 0 N--CA 1.453 -0.868 0 N-CA-C 113.633 0.59 . . . . 0.0 113.633 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.531 HG12 HD13 ' A' ' 77' ' ' LEU . 9.3 tp 179.66 26.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.968 0.89 . . . . 0.0 109.666 174.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.466 ' HB2' HG12 ' A' ' 98' ' ' ILE . 6.5 p30 -161.88 105.3 1.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.793 -175.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.522 ' HB2' ' HG ' ' A' ' 62' ' ' LEU . 68.5 m-85 -142.89 161.65 37.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.039 -177.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 60' ' ' SER . 13.9 m -60.43 142.97 54.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.612 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 2.5 pp20? -60.01 -36.95 78.32 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.488 ' H ' HG22 ' A' ' 58' ' ' THR . 6.5 m -67.53 -29.19 68.53 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.187 176.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 33.5 tt0 -77.24 -34.51 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.88 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.522 ' HG ' ' HB2' ' A' ' 57' ' ' TYR . 87.5 mt -77.18 -21.24 54.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.11 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 29.4 mmtp -62.12 -40.24 95.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.906 172.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.82 47.68 2.5 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.155 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.482 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.9 mtt -141.03 136.52 32.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.464 ' ND2' ' HG2' ' A' ' 69' ' ' GLU . 11.2 p30 -71.17 173.2 7.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.015 0.436 . . . . 0.0 110.728 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.37 -41.21 94.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.009 -175.255 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.87 79.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.599 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.548 ' O ' HG13 ' A' ' 73' ' ' ILE . 58.7 mm-40 -59.6 -52.85 63.76 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.522 ' O ' HG13 ' A' ' 74' ' ' ILE . 32.2 m-70 -52.46 -41.7 63.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.604 178.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 54.3 mt-10 -66.38 -45.64 79.38 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.709 -177.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.0 m -59.13 -47.0 86.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.666 0.269 . . . . 0.0 110.565 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.3 mt -50.99 -62.32 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.75 -178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.7 mt -74.59 -24.69 18.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.21 -172.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.0 t -68.04 -29.75 68.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.402 HD22 ' N ' ' A' ' 76' ' ' ASN . 0.9 OUTLIER -78.92 -25.17 43.69 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.911 0.386 . . . . 0.0 110.257 176.404 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.531 HD13 HG12 ' A' ' 55' ' ' ILE . 37.8 tp -67.59 -37.84 83.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.941 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.59 -1.49 10.26 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.688 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -107.1 133.71 51.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.848 0.356 . . . . 0.0 110.93 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.561 ' OD1' ' HB3' ' A' ' 82' ' ' SER . 23.9 t-20 -66.19 117.46 43.3 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.462 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.78 -5.6 17.49 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.632 2.221 . . . . 0.0 112.913 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.561 ' HB3' ' OD1' ' A' ' 80' ' ' ASN . 42.1 t -80.31 -9.01 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 177.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -69.57 -21.67 63.6 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -112.67 108.62 17.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.288 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -83.12 -41.72 18.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.259 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -89.36 150.48 22.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.068 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -37.96 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.355 176.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.32 -52.0 60.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.575 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -61.23 -43.57 98.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.025 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.415 ' O ' HG13 ' A' ' 94' ' ' ILE . 94.6 mtt180 -64.3 -41.89 96.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.319 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -66.77 -45.71 87.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.137 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 -38.65 80.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.818 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -70.91 -39.18 72.89 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.921 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.4 mt -66.07 -32.5 58.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.228 0.537 . . . . 0.0 109.94 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 HD12 ' A' ' 98' ' ' ILE . 4.0 mm? -73.86 -21.25 60.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.968 174.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -68.85 -33.05 73.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.717 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.458 HE21 HG13 ' A' ' 55' ' ' ILE . 2.6 mp0 -67.75 -36.35 80.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 109.988 175.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.522 HD12 HD13 ' A' ' 95' ' ' LEU . 43.2 mt -67.61 -32.54 57.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.149 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.0 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.614 174.363 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.545 0.212 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.6 p -121.29 132.22 54.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.139 0.495 . . . . 0.0 110.943 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.6 128.87 55.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.356 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.461 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 6.0 ttpm? -114.13 121.63 44.36 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.626 0.25 . . . . 0.0 110.502 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.628 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 55.2 tp -62.84 124.95 22.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.99 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.0 pt -120.43 5.42 6.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.761 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -132.89 104.76 6.74 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.365 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.86 -121.27 5.64 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.629 ' HD2' ' HB3' ' A' ' 21' ' ' ALA . 41.9 tptt -169.38 -45.66 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 p -135.56 113.45 11.09 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.561 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -123.12 112.8 18.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.273 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.503 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 28.2 t-20 -92.63 107.79 19.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.941 0.401 . . . . 0.0 110.528 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.32 110.3 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.733 177.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 65.17 -80.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.808 0.693 . . . . 0.0 111.091 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -137.31 -1.93 2.43 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.237 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -104.64 115.98 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -178.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.3 m -89.38 106.25 18.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.927 0.394 . . . . 0.0 110.396 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -85.38 146.6 26.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.211 178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 75.7 mtt180 -121.25 132.46 54.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.193 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.629 ' HB3' ' HD2' ' A' ' 10' ' ' LYS . . . -59.51 112.93 1.96 Allowed 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.024 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.51 -12.03 25.76 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.058 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.7 t -116.63 119.55 62.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.649 0.261 . . . . 0.0 111.129 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.423 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 9.7 m -82.29 123.24 28.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -119.1 143.94 46.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.75 0.31 . . . . 0.0 110.642 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -70.74 131.24 43.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.421 -175.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.2 m -131.19 151.4 78.81 Favored Pre-proline 0 C--O 1.235 0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.537 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.547 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.9 Cg_exo -68.43 166.16 26.54 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.81 2.34 . . . . 0.0 111.671 175.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -62.14 -33.9 75.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.286 -175.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.96 -46.25 90.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.775 0.321 . . . . 0.0 110.63 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.547 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.3 mt -74.54 -23.22 58.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.697 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -62.63 -46.48 88.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 176.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 24.5 tp10 -76.22 -34.61 59.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.216 0.531 . . . . 0.0 110.198 177.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.457 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 49.5 t80 -58.55 -48.55 80.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.269 177.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD22 ' CE2' ' A' ' 41' ' ' PHE . 79.6 mt -79.55 -15.19 58.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.684 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.466 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 45.1 t30 -62.01 -40.56 96.1 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 173.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.5 5.32 31.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.915 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 35' ' ' LEU . 32.0 m-80 -123.9 97.51 41.05 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.824 0.345 . . . . 0.0 110.427 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -70.77 63.93 2.39 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 123.4 2.733 . . . . 0.0 113.359 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.435 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 81.1 m-85 -120.43 -14.02 8.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.011 173.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.568 ' CE2' HD22 ' A' ' 35' ' ' LEU . 57.3 m-85 -129.21 151.42 49.9 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.211 -167.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.7 tt -97.24 118.45 43.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 166.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.6 mt -94.35 129.28 41.11 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.227 -175.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 -176.247 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo . . . . . 0 N--CA 1.457 -0.67 0 N-CA-C 113.673 0.605 . . . . 0.0 113.673 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -174.94 35.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 122.293 1.044 . . . . 0.0 109.496 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -156.72 82.41 0.95 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.989 -172.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.413 ' N ' HD11 ' A' ' 98' ' ' ILE . 70.1 m-85 -142.37 150.06 40.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.687 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.937 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 14.0 m -60.82 138.75 58.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.562 0.22 . . . . 0.0 111.155 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.63 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.1 -37.43 77.13 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.171 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.55 ' H ' HG22 ' A' ' 58' ' ' THR . 18.6 m -70.01 -20.51 63.27 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.695 177.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.937 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 47.8 mm-40 -80.93 -45.62 16.42 Favored 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 120.227 -0.589 . . . . 0.0 109.713 173.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 87.4 mt -68.03 -18.58 64.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.842 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 1.6 mptm? -67.01 -33.46 75.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.943 0.402 . . . . 0.0 110.494 174.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.74 -22.01 27.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.049 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.9 mtp -73.32 136.69 44.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 110.423 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -70.65 167.36 18.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.261 -174.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 1.5 tmmt? -60.51 -41.24 93.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.9 68.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.862 176.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' O ' HG13 ' A' ' 73' ' ' ILE . 13.7 mm-40 -67.45 -50.01 61.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.204 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.487 ' HE1' HD13 ' A' ' 91' ' ' ILE . 85.2 m-70 -52.14 -44.5 64.59 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.698 175.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 86.4 mt-10 -60.42 -53.78 53.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.679 176.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.5 m -51.96 -44.39 63.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.972 0.415 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.1 mt -59.72 -62.52 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.711 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.588 HD12 ' HB3' ' A' ' 81' ' ' PRO . 4.4 mt -78.13 -10.4 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.627 -170.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m -80.82 -33.22 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.129 -0.357 . . . . 0.0 110.052 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -70.35 -27.11 64.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.108 0.48 . . . . 0.0 109.794 174.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.3 -23.35 65.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.968 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.41 18.61 52.22 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.579 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -40.08 6.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.659 0.229 . . . . 0.0 110.655 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 67.91 105.64 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.786 0.679 . . . . 0.0 110.832 -176.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.588 ' HB3' HD12 ' A' ' 74' ' ' ILE . 90.2 Cg_endo -84.2 34.17 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.805 2.337 . . . . 0.0 112.864 -177.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 p -76.41 -26.37 55.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.483 177.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.28 -31.99 62.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.435 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -82.56 108.86 16.27 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.57 -31.79 28.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.273 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.881 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 86.1 m-20 -92.27 141.69 28.29 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.62 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.276 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -60.4 -37.76 81.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.468 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.881 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 31.2 mm-40 -65.81 -35.05 79.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.465 0.65 . . . . 0.0 109.62 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -70.53 -35.4 73.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 176.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 87' ' ' ALA . 37.5 mm -61.93 -54.07 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -58.31 -40.27 81.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.869 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -67.7 -46.15 73.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.525 0.202 . . . . 0.0 111.067 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.76 -41.49 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.14 0.495 . . . . 0.0 109.885 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.523 HD13 HD12 ' A' ' 98' ' ' ILE . 4.2 mm? -67.99 -29.65 68.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.111 178.179 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 38.5 tptt -72.52 -18.43 61.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.058 0.456 . . . . 0.0 110.778 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.15 -30.28 27.97 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 95' ' ' LEU . 39.4 mt -71.19 -35.61 58.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.0 t70 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.532 176.18 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.8 p -114.9 148.36 38.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.966 0.412 . . . . 0.0 110.618 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -130.95 134.54 46.83 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.133 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.786 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 1.6 ttmp? -120.16 118.75 31.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.135 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.686 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 40.0 tp -71.3 128.2 35.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.821 HG13 ' HG3' ' A' ' 8' ' ' LYS . 41.5 pt -113.74 -17.16 8.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.866 0.365 . . . . 0.0 110.986 -177.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.821 ' HG3' HG13 ' A' ' 7' ' ' ILE . 96.5 mttt -133.1 138.69 46.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -177.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.66 -13.93 24.87 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.854 178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.6 tttm 73.92 -52.89 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.532 0.733 . . . . 0.0 110.924 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.5 m -151.94 119.33 5.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.93 177.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.458 ' CE2' HG22 ' A' ' 14' ' ' VAL . 30.2 t80 -141.19 126.33 18.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.731 -178.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -92.14 125.49 36.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.912 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.458 HG22 ' CE2' ' A' ' 12' ' ' TYR . 47.9 t -104.81 104.94 17.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 175.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.5 mtt 65.41 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.112 -175.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.83 0.04 2.07 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.517 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.7 mp -101.3 123.48 54.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 m -83.31 116.61 22.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.943 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 96.9 m-85 -106.23 140.61 38.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.745 0.307 . . . . 0.0 110.189 175.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -127.66 148.28 50.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.686 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.21 112.29 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.624 0.249 . . . . 0.0 111.167 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.08 5.28 57.36 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.387 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.6 112.37 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.997 0.427 . . . . 0.0 110.15 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.786 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 16.0 m -92.45 123.98 36.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.63 150.41 51.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.819 0.343 . . . . 0.0 111.001 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 m -79.78 138.81 37.36 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.127 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.52 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 34.7 m -134.93 158.23 75.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.723 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.6 Cg_exo -68.95 171.32 13.76 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.769 2.313 . . . . 0.0 111.577 173.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.502 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 11.4 tmtt? -66.19 -31.13 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -177.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.84 -53.81 52.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.451 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.52 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 65.3 mt -70.23 -34.69 73.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.214 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -56.18 -46.77 79.26 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -71.53 -43.15 66.98 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.895 0.379 . . . . 0.0 110.574 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -58.0 -38.52 76.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.662 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.531 HD22 ' CE1' ' A' ' 41' ' ' PHE . 78.6 mt -88.75 -9.01 53.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.047 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -76.44 -23.94 53.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 172.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -84.41 -12.95 53.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.526 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -112.41 103.27 55.34 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.659 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.55 11.44 0.48 Allowed 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.411 2.74 . . . . 0.0 114.195 -173.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -85.1 -3.72 58.9 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.582 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 79.1 m-85 -118.82 131.47 56.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.11 -176.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.564 HG13 HD13 ' A' ' 7' ' ' ILE . 27.9 mt -97.45 104.12 15.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 166.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 4.7 mp -88.74 162.44 16.24 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.357 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.321 -0.658 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.001 -177.893 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.551 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 71.8 Cg_endo . . . . . 0 CA--C 1.53 0.279 0 CA-C-O 120.849 0.27 . . . . 0.0 112.465 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.669 HG12 HD13 ' A' ' 77' ' ' LEU . 9.6 tp -170.7 22.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.454 1.121 . . . . 0.0 109.042 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.754 HD22 HG12 ' A' ' 98' ' ' ILE . 2.6 t-20 -159.11 98.86 1.47 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.679 -173.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.551 ' OH ' ' HA ' ' A' ' 54' ' ' PRO . 95.9 m-85 -140.11 -174.66 3.99 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.51 -176.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.729 ' HB ' ' HB3' ' A' ' 61' ' ' GLU . 3.0 m -79.59 129.47 34.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.583 ' HB3' HD21 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -63.29 -39.65 95.17 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.822 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.51 ' HA ' ' HE3' ' A' ' 63' ' ' LYS . 50.2 m -64.95 -29.3 70.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.978 0.418 . . . . 0.0 109.971 174.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.729 ' HB3' ' HB ' ' A' ' 58' ' ' THR . 39.7 tt0 -76.23 -38.75 55.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.96 -27.52 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.245 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 60' ' ' SER . 48.3 mtmt -76.42 -1.24 26.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.26 26.46 8.2 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 172.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.506 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 24.1 mmt -119.33 161.71 20.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.554 -0.323 . . . . 0.0 110.444 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 16.2 m-80 -91.62 -167.81 1.88 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.472 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -79.46 -35.22 40.69 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.229 -177.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.12 77.23 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.409 0.443 . . . . 0.0 112.017 -171.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HG3' ' HB3' ' A' ' 65' ' ' MET . 2.6 pm0 -63.03 -47.0 84.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.775 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.52 ' HE1' HG12 ' A' ' 91' ' ' ILE . 19.7 m-70 -55.31 -41.37 72.28 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.565 0.222 . . . . 0.0 111.079 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.485 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 42.6 mt-10 -65.73 -50.15 65.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.986 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 m -58.59 -38.11 77.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.481 HG23 ' O ' ' A' ' 54' ' ' PRO . 69.1 mt -54.61 -61.97 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.407 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.518 HD12 ' HB3' ' A' ' 81' ' ' PRO . 2.0 mt -79.3 -21.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.983 -170.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.5 p -71.19 -25.5 62.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.541 -0.464 . . . . 0.0 109.779 175.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -76.25 -33.35 59.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.107 172.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.669 HD13 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -62.47 -38.89 91.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.117 0.484 . . . . 0.0 110.708 174.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.32 -46.99 1.04 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.233 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.521 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 48.8 ttt85 -77.37 111.7 13.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.134 0.492 . . . . 0.0 109.768 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -62.32 130.66 93.33 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.085 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.518 ' HB3' HD12 ' A' ' 74' ' ' ILE . 91.9 Cg_endo -86.53 24.92 0.71 Allowed 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 123.254 2.636 . . . . 0.0 112.718 -177.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.2 m -73.65 -36.81 65.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.921 0.391 . . . . 0.0 110.344 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -73.59 -27.42 61.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.535 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.421 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 87.7 m-85 -82.52 108.88 16.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.293 177.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 37.3 ttmt -99.37 -54.61 2.91 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.05 -171.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -83.15 158.47 22.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.903 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.11 73.23 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.173 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -50.44 -49.23 55.57 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.637 0.586 . . . . 0.0 110.882 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.18 -49.39 74.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.981 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.7 mtt180 -64.2 -43.52 94.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.085 -176.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.52 HG12 ' HE1' ' A' ' 70' ' ' HIS . 91.1 mt -71.3 -43.88 73.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.178 -176.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -58.81 -40.21 83.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 111.174 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.521 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 41.9 t80 -68.1 -42.57 80.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.47 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.503 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.9 mt -60.92 -39.71 82.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.583 HD21 ' HB3' ' A' ' 59' ' ' GLU . 38.3 mt -55.55 -40.73 72.26 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.025 177.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 92' ' ' ALA . 66.0 mttm -60.33 -34.27 73.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.391 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -83.55 -18.99 36.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.014 0.435 . . . . 0.0 110.621 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.754 HG12 HD22 ' A' ' 56' ' ' ASN . 78.1 mt -70.07 -41.79 79.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.912 176.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.559 176.797 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 120.727 0.299 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 p -127.42 139.55 52.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.431 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.17 128.2 54.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -111.32 105.5 14.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.018 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 50.6 tp -65.72 116.89 7.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.562 HG21 HG13 ' A' ' 42' ' ' ILE . 42.5 pt -107.1 -29.87 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.811 0.339 . . . . 0.0 111.58 -175.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 50.4 mttm -106.5 128.91 54.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.322 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.24 -128.51 8.57 Favored Glycine 0 N--CA 1.441 -0.981 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.126 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -170.12 -46.94 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -175.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.26 113.49 6.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.685 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -123.1 104.21 9.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.338 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 23.8 t-20 -90.23 122.2 32.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.848 0.356 . . . . 0.0 111.034 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.8 t -119.99 111.78 34.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.763 174.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.1 mtt 64.52 -95.29 0.04 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.884 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.94 17.42 6.33 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.056 -0.593 . . . . 0.0 111.712 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 HD11 ' A' ' 31' ' ' LEU . 4.6 mp -123.42 110.87 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 30.5 m -90.53 107.34 19.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.631 177.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 91.9 m-85 -84.91 151.02 24.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 179.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 46.6 mtm180 -133.83 145.68 49.93 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.562 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -54.61 114.82 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.993 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.84 -7.16 67.54 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.626 177.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.6 t -100.82 125.43 54.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.873 0.368 . . . . 0.0 111.275 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 m -94.59 121.73 36.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.122 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -124.57 146.06 49.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.601 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.8 m -75.13 126.71 31.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.6 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.9 m -122.75 154.33 63.65 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-O 120.678 0.275 . . . . 0.0 111.45 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.565 ' HD2' HD12 ' A' ' 31' ' ' LEU . 21.2 Cg_exo -66.86 164.23 30.4 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.8 2.334 . . . . 0.0 111.015 172.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -64.19 -32.58 74.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.001 -175.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -54.57 -52.02 63.44 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.995 0.426 . . . . 0.0 110.489 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 28' ' ' PRO . 49.3 mt -67.92 -33.63 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.472 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 87.4 t80 -59.13 -44.13 92.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.879 0.371 . . . . 0.0 110.305 178.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -77.7 -40.17 42.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -59.76 -40.43 88.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.329 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -87.67 -13.48 42.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 8.1 t30 -63.83 -36.9 85.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.16 8.18 16.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.468 176.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 31.5 m-80 -127.99 91.93 43.46 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.118 0.485 . . . . 0.0 110.157 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -75.14 57.0 4.51 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.745 2.963 . . . . 0.0 114.643 -169.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 3.3 p90 -133.58 22.36 3.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.649 0.738 . . . . 0.0 110.121 170.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.79 148.93 50.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.766 175.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 HG21 ' A' ' 7' ' ' ILE . 50.3 mt -97.03 110.09 24.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 163.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 68.6 mt -91.84 133.1 35.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.367 -175.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.419 -177.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.423 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 11.9 Cg_exo . . . . . 0 CA--C 1.528 0.219 0 N-CA-C 113.033 0.359 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.83 HG12 HD13 ' A' ' 77' ' ' LEU . 9.5 tp -179.47 26.67 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 122.047 0.927 . . . . 0.0 109.716 175.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.538 ' HB3' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -163.78 98.09 0.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.654 -174.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -142.3 160.13 40.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.502 -177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.498 ' HB ' ' H ' ' A' ' 61' ' ' GLU . 1.7 m -57.16 137.3 56.04 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.467 0.479 . . . . 0.0 110.175 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HB3' HD11 ' A' ' 95' ' ' LEU . 0.6 OUTLIER -62.81 -31.17 72.11 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.369 -0.532 . . . . 0.0 109.865 176.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.2 t -64.87 -41.38 95.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.599 172.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -68.35 -42.17 79.65 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.35 179.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.456 HD23 ' SD ' ' A' ' 65' ' ' MET . 99.9 mt -66.39 -32.62 74.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.41 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HG3' HD13 ' A' ' 91' ' ' ILE . 43.1 mtmt -76.71 -16.96 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.055 0.455 . . . . 0.0 110.538 175.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.05 23.27 36.63 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.636 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.1 mtt -117.67 160.71 20.85 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.271 0.558 . . . . 0.0 111.042 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.572 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 38.6 t30 -74.02 152.54 39.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.055 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 49.4 mtmt -52.45 -47.07 66.64 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.337 177.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.3 64.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.776 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 26.8 mm-40 -66.21 -44.45 83.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.579 ' O ' HG13 ' A' ' 74' ' ' ILE . 76.3 m-70 -57.64 -42.84 84.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.09 0.472 . . . . 0.0 110.247 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 4.3 mm-40 -63.5 -46.25 86.96 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.65 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.8 p -72.57 -36.18 68.14 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.643 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 69' ' ' GLU . 81.7 mt -56.6 -55.86 17.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.18 0.514 . . . . 0.0 110.716 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.4 mt -77.14 -18.58 14.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.019 0.438 . . . . 0.0 110.537 -175.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.1 t -64.65 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.11 -34.97 79.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.297 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.83 HD13 HG12 ' A' ' 55' ' ' ILE . 58.2 tp -59.06 -34.89 72.48 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.183 0.515 . . . . 0.0 110.545 174.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.22 14.73 11.4 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.036 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HD3' ' OH ' ' A' ' 93' ' ' TYR . 48.9 ttt180 -145.78 92.76 2.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.147 0.498 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.578 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 51.0 t30 -58.67 132.48 85.99 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.676 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.578 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 85.2 Cg_exo -44.95 84.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.987 3.125 . . . . 0.0 113.575 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.3 t -78.83 108.63 12.41 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.925 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.5 t70 51.68 62.05 2.9 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.978 0.799 . . . . 0.0 111.731 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -116.97 108.09 15.36 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 171.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -99.6 -32.4 11.11 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.065 0.46 . . . . 0.0 110.246 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -72.1 124.33 24.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.98 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.43 88.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.888 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.56 -25.87 67.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.288 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -67.38 -42.68 82.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.685 0.279 . . . . 0.0 110.551 -177.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 mtt-85 -62.07 -43.59 98.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.372 0.606 . . . . 0.0 109.779 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.411 HD13 ' HG3' ' A' ' 63' ' ' LYS . 45.1 mt -67.63 -42.51 86.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.229 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.35 78.17 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.271 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.438 ' OH ' ' HD3' ' A' ' 79' ' ' ARG . 30.1 t80 -68.91 -38.84 79.83 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.206 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.445 ' O ' HG13 ' A' ' 98' ' ' ILE . 73.6 mt -65.82 -47.16 86.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.02 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 59' ' ' GLU . 95.1 mt -62.09 -38.36 88.58 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.082 0.468 . . . . 0.0 111.013 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -61.85 -36.5 81.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.426 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -22.51 60.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.538 HG12 ' HB3' ' A' ' 56' ' ' ASN . 53.6 mt -73.57 -40.31 54.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 109.686 175.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.5 t70 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.156 179.724 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.417 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 61.3 m-85 . . . . . 0 N--CA 1.453 -0.287 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.4 t -126.37 147.39 49.77 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.63 135.23 54.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.933 0.397 . . . . 0.0 110.918 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -119.4 118.35 30.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.462 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.66 130.42 43.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 42' ' ' ILE . 40.4 pt -120.14 -0.52 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.835 0.35 . . . . 0.0 111.408 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 88.7 tttt -135.71 121.54 19.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.79 -174.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 100.43 -125.05 8.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.45 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 38.6 ttmt -155.37 -52.08 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.5 m -144.29 126.48 15.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.907 0.384 . . . . 0.0 111.168 -178.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -142.5 131.04 22.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.033 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 65.1 t30 -93.92 120.54 34.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.113 0.482 . . . . 0.0 111.166 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 90.7 t -99.89 95.17 3.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.914 176.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.3 mtt 62.8 -81.02 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.826 -176.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.17 -2.13 5.59 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.96 177.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -103.57 105.62 18.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -178.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 4.1 m -86.2 117.69 25.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.878 0.371 . . . . 0.0 110.545 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 25' ' ' GLN . 96.1 m-85 -103.88 152.95 21.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 36.5 mtm180 -124.09 139.77 53.61 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.821 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.774 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -51.13 118.63 3.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.108 0.48 . . . . 0.0 111.24 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.89 -22.46 35.23 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.3 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -93.16 122.4 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 110.698 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -95.19 125.55 39.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.746 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 19' ' ' PHE . 25.9 mt-30 -130.87 140.72 50.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.061 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.0 p -67.7 133.25 48.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.741 -175.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -121.96 149.63 54.29 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.327 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.544 ' HD2' HD12 ' A' ' 31' ' ' LEU . 22.5 Cg_exo -65.74 163.12 31.72 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.766 2.311 . . . . 0.0 110.774 171.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -63.27 -29.04 70.44 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.433 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.75 -53.69 50.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.437 175.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.544 HD12 ' HD2' ' A' ' 28' ' ' PRO . 67.2 mt -67.98 -25.55 65.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.038 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 81.2 t80 -59.68 -47.26 86.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 176.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -73.21 -38.75 65.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.807 0.337 . . . . 0.0 110.628 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.414 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 86.9 t80 -58.29 -47.64 83.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.914 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.55 ' HB2' HD21 ' A' ' 43' ' ' LEU . 89.2 mt -80.63 -22.21 40.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.035 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 53.3 t30 -63.29 -28.79 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.512 0.673 . . . . 0.0 109.729 174.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -81.39 0.05 39.19 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.59 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -121.76 116.61 30.28 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.205 0.526 . . . . 0.0 111.258 -176.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.59 10.37 2.25 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 123.169 2.579 . . . . 0.0 114.605 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 5.4 p90 -107.02 12.09 29.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.438 0.637 . . . . 0.0 110.482 177.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -127.35 127.58 44.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.325 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 7' ' ' ILE . 50.4 mt -97.52 109.96 24.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.55 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.2 mp -94.83 149.78 20.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.822 -178.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.7 m . . . . . 0 C--N 1.317 -0.821 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 -177.828 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo . . . . . 0 N--CA 1.451 -1.023 0 N-CA-C 111.967 -0.051 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.666 HG12 HD22 ' A' ' 77' ' ' LEU . 10.7 tp 38.78 61.2 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.863 0.865 . . . . 0.0 112.951 173.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -174.43 87.52 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.586 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -142.86 161.94 36.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.736 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.643 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 2.0 m -74.19 143.74 45.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.627 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -34.69 78.77 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.357 0.599 . . . . 0.0 109.959 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.6 m -75.83 -25.95 56.74 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.582 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.643 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 56.2 tt0 -77.19 -44.81 28.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.405 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.688 ' HB3' ' HE1' ' A' ' 70' ' ' HIS . 89.9 mt -65.2 -33.6 76.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.585 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -72.45 -12.75 61.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.843 176.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.56 28.48 13.26 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 176.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.478 ' SD ' HD23 ' A' ' 62' ' ' LEU . 58.2 mtt -119.67 -171.24 2.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 111.078 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.53 ' ND2' ' H ' ' A' ' 68' ' ' ALA . 4.9 t30 -114.7 162.92 16.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.668 176.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 18.9 ptmt -56.05 -40.24 73.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.53 ' H ' ' ND2' ' A' ' 66' ' ' ASN . . . -56.72 -49.68 74.44 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -170.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.536 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 pm0 -59.39 -46.88 87.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.077 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.688 ' HE1' ' HB3' ' A' ' 62' ' ' LEU . 89.0 m-70 -50.38 -50.7 50.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.972 0.415 . . . . 0.0 110.922 177.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 4.0 mm-40 -61.88 -43.66 98.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.704 -176.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -63.03 -44.4 96.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.742 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.8 mt -52.63 -58.33 2.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.919 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.478 HD12 ' HB3' ' A' ' 81' ' ' PRO . 0.8 OUTLIER -75.48 -21.88 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.043 -172.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.9 m -70.63 -23.95 62.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.848 0.356 . . . . 0.0 110.699 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.96 -30.11 28.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.101 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.666 HD22 HG12 ' A' ' 55' ' ' ILE . 51.2 tp -67.75 -37.97 82.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.848 174.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 133.94 -60.82 0.65 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.016 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 62.1 ttt180 -65.92 108.1 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 80' ' ' ASN . 11.2 m120 -63.74 142.36 98.04 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.649 -175.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 55.2 Cg_endo -67.13 -7.6 19.31 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 123.569 2.846 . . . . 0.0 112.51 -176.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.7 m -64.25 -17.58 63.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.77 179.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -76.2 -20.34 57.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.257 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -111.11 112.72 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.016 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.75 -36.04 32.51 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -173.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.4 ' HB3' ' OD1' ' A' ' 88' ' ' ASP . 66.8 t30 -107.01 164.22 12.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.74 0.305 . . . . 0.0 110.642 -176.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.436 ' HA ' ' HD2' ' A' ' 90' ' ' ARG . . . -64.89 -34.12 77.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.847 -177.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.4 ' OD1' ' HB3' ' A' ' 86' ' ' ASN . 22.8 p-10 -64.24 -47.4 79.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.207 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -60.25 -38.25 82.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.911 0.386 . . . . 0.0 110.843 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 87' ' ' ALA . 55.3 mtt85 -58.78 -52.22 66.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.431 175.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.77 -44.54 96.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.258 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.24 -41.32 75.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.432 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 27.2 t80 -72.58 -34.86 67.74 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.998 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.8 mt -67.77 -41.87 85.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 98' ' ' ILE . 4.4 mm? -65.71 -38.53 89.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.766 176.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -57.33 -37.71 72.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.929 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -7.77 59.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.948 -175.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 95' ' ' LEU . 27.9 mt -72.91 -44.82 57.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 173.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.571 -179.591 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.9 p -122.9 136.35 54.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.771 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.4 117.72 29.25 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.657 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.448 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 34.9 ttpt -106.63 121.22 43.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.062 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.825 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 26.0 tp -66.42 116.08 7.04 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.557 HG13 ' HG3' ' A' ' 8' ' ' LYS . 31.9 pt -106.15 -13.08 9.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 120.96 0.41 . . . . 0.0 111.586 -174.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HG3' HG13 ' A' ' 7' ' ' ILE . 95.2 mttt -130.36 109.88 11.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.183 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.6 -120.49 2.56 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.229 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -171.72 -66.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 m -135.05 113.05 11.06 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.45 ' CE2' HG22 ' A' ' 14' ' ' VAL . 26.1 t80 -133.08 130.55 39.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.95 0.405 . . . . 0.0 111.056 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -97.65 125.53 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.831 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 35' ' ' LEU . 44.4 t -112.58 115.89 51.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.421 ' SD ' HD21 ' A' ' 31' ' ' LEU . 61.4 mtt 67.88 -73.85 0.08 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.478 0.711 . . . . 0.0 111.076 -177.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 19.75 0.28 Allowed Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.469 HD13 HD11 ' A' ' 31' ' ' LEU . 3.9 mp -118.15 137.34 52.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.0 m -95.08 118.0 31.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 111.548 -176.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 77.5 m-85 -106.16 140.11 39.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.028 177.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.402 ' HB2' ' HB ' ' A' ' 23' ' ' VAL . 79.3 mtp180 -122.82 142.46 50.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.096 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.825 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -65.54 106.13 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.003 0.43 . . . . 0.0 110.725 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 109.6 -5.38 31.19 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.204 -178.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.402 ' HB ' ' HB2' ' A' ' 20' ' ' ARG . 61.0 t -113.61 122.11 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.838 0.351 . . . . 0.0 110.705 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 12.4 m -82.13 100.59 9.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.216 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -86.72 142.26 28.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.624 -176.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.5 m -81.1 125.43 30.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.65 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 33.0 m -130.49 155.82 80.53 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.253 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -74.27 162.22 38.96 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.53 2.153 . . . . 0.0 110.539 170.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 83.1 tttt -60.55 -23.81 64.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.61 0.243 . . . . 0.0 110.824 -178.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -56.6 -52.08 66.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.083 0.468 . . . . 0.0 109.893 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 59.2 mt -75.78 -29.06 58.63 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.768 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 89.8 t80 -57.47 -43.26 83.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.006 0.432 . . . . 0.0 110.513 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -80.09 -40.01 28.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.27 0.557 . . . . 0.0 110.305 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.19 -35.1 76.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.958 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 14' ' ' VAL . 90.3 mt -92.68 -15.72 26.39 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.259 -0.276 . . . . 0.0 110.901 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.43 -37.38 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.0 109.817 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.73 6.61 10.38 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.67 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -116.15 113.78 41.34 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.046 0.451 . . . . 0.0 110.424 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.92 23.74 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 123.206 2.604 . . . . 0.0 114.517 -171.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 6.8 p90 -122.25 16.69 10.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.498 0.666 . . . . 0.0 110.392 175.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.507 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.49 135.5 49.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.779 173.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.448 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.7 tt -98.81 128.37 50.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.97 118.17 32.67 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.166 -0.613 . . . . 0.0 111.371 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.967 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.5 ' O ' HG22 ' A' ' 55' ' ' ILE . 17.2 Cg_endo . . . . . 0 CA--C 1.529 0.25 0 N-CA-C 113.436 0.514 . . . . 0.0 113.436 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' O ' ' A' ' 54' ' ' PRO . 7.6 tp 52.29 26.84 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.389 1.075 . . . . 0.0 111.951 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.405 ' OD1' HG13 ' A' ' 98' ' ' ILE . 6.2 t30 -147.62 80.75 1.5 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.448 0.642 . . . . 0.0 109.68 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -138.23 159.36 42.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.712 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.59 148.38 35.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.631 174.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 35.5 tt0 -57.43 -42.76 83.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 176.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m -59.85 -32.67 70.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.189 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.66 -37.27 59.75 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.102 0.477 . . . . 0.0 110.393 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.469 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 85.8 mt -81.25 -18.99 44.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.957 -177.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 31.2 mmtp -65.15 -29.81 70.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.973 0.416 . . . . 0.0 110.996 177.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.09 2.52 79.27 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.358 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.43 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -103.19 137.78 40.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.778 0.323 . . . . 0.0 110.222 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.461 ' O ' ' HD2' ' A' ' 70' ' ' HIS . 39.0 m-80 -74.78 171.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.776 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.572 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -58.2 -36.97 73.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.073 -178.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.88 91.33 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.541 0.526 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 mp0 -57.41 -47.13 82.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.901 0.382 . . . . 0.0 110.382 177.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.587 ' O ' HG13 ' A' ' 74' ' ' ILE . 36.1 m-70 -58.22 -41.63 84.52 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 177.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 43.4 mt-10 -59.57 -49.75 76.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.239 -178.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 p -63.99 -34.29 77.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.664 0.269 . . . . 0.0 111.259 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.7 mt -61.39 -54.88 29.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.16 0.505 . . . . 0.0 111.006 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.587 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.7 mt -75.34 -21.53 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.799 -174.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 73.9 m -64.57 -37.3 87.07 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.23 -34.26 75.91 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.179 175.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.473 HD13 HG21 ' A' ' 55' ' ' ILE . 42.8 tp -64.81 -37.63 88.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.775 175.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.36 23.16 5.84 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.728 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.523 ' HB3' HG22 ' A' ' 74' ' ' ILE . 3.9 tpt180 -125.31 131.65 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -66.02 116.12 29.74 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 121.513 0.673 . . . . 0.0 110.331 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -83.38 -5.33 11.01 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.827 2.352 . . . . 0.0 113.167 -175.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.5 t -77.57 -0.13 25.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.404 178.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -77.81 -15.89 58.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.413 0.625 . . . . 0.0 109.713 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -102.52 128.04 49.32 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.002 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -84.83 -26.02 27.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.905 0.383 . . . . 0.0 111.09 -173.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.521 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 30.4 p30 -126.01 169.75 12.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.332 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.29 -18.24 59.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.589 0.233 . . . . 0.0 111.271 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.09 -49.27 68.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.894 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -62.94 -32.62 73.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.823 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 46.4 mtt-85 -65.35 -40.02 93.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.987 178.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.0 mt -62.83 -47.44 92.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.199 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.92 -39.72 78.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.621 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.98 -45.39 77.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.791 0.329 . . . . 0.0 110.39 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.9 mt -66.21 -39.13 83.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.505 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 91' ' ' ILE . 56.3 mt -65.77 -30.05 70.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.833 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -80.56 -34.73 35.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.257 0.551 . . . . 0.0 110.32 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.66 -30.57 56.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.408 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.405 HG13 ' OD1' ' A' ' 56' ' ' ASN . 10.5 tt -69.44 -23.98 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 121.173 0.511 . . . . 0.0 109.794 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.4 t70 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.288 175.387 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.582 0.23 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 24' ' ' SER . 26.0 p -129.6 142.78 50.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.842 0.353 . . . . 0.0 111.288 177.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.518 ' O ' ' HA ' ' A' ' 24' ' ' SER . . . -118.52 140.93 49.11 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 36.3 ttpt -122.07 123.29 41.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.146 0.498 . . . . 0.0 111.412 -175.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.525 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 3.4 tm? -73.86 125.28 27.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.182 176.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.551 HD13 HG13 ' A' ' 42' ' ' ILE . 43.4 pt -112.12 -15.06 10.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.601 -178.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.463 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 83.2 tttt -140.99 113.66 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.632 0.253 . . . . 0.0 110.811 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.68 -5.69 5.5 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.232 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? 73.6 -53.75 0.69 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.086 0.554 . . . . 0.0 110.784 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.496 HG22 ' HG2' ' A' ' 20' ' ' ARG . 1.4 p -147.02 142.2 27.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.378 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -152.91 140.34 19.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -107.76 129.36 55.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.936 -177.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -126.84 101.2 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.373 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . 0.515 ' SD ' HD21 ' A' ' 31' ' ' LEU . 65.9 mtt 56.05 32.98 21.03 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.666 176.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.35 -24.76 26.76 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.324 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.09 118.6 21.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 20.5 m -100.05 105.45 17.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.178 0.513 . . . . 0.0 111.053 -176.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.525 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 95.2 m-85 -92.44 153.25 19.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.016 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HG2' HG22 ' A' ' 11' ' ' THR . 83.3 mtt85 -133.57 153.91 51.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.412 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.51 111.06 0.8 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.994 0.426 . . . . 0.0 111.218 176.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.8 6.37 67.52 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.636 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 87.9 t -114.55 110.32 31.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.04 0.448 . . . . 0.0 111.139 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.532 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 24.8 p -86.7 114.94 23.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.686 174.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -110.51 159.27 17.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.4 p -67.45 135.23 52.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.949 0.404 . . . . 0.0 112.022 -175.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 31.4 m -129.76 144.08 51.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.188 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.555 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -66.21 167.89 17.23 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 123.24 2.626 . . . . 0.0 112.211 174.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -55.66 -40.28 72.05 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.421 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -75.57 -34.15 60.66 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.227 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.555 HD12 ' HD2' ' A' ' 28' ' ' PRO . 34.9 mt -75.99 -25.6 55.94 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.036 -179.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.48 -42.88 97.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.962 0.41 . . . . 0.0 110.087 176.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.96 -38.06 46.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.53 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -57.5 -43.5 84.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HB2' HD21 ' A' ' 43' ' ' LEU . 92.3 mt -84.72 -20.22 31.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.982 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -62.3 -36.6 82.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.357 0.598 . . . . 0.0 109.978 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 24.85 3.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.43 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -116.8 121.77 32.41 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.847 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.62 -32.63 93.56 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.274 2.649 . . . . 0.0 114.238 -174.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.463 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 6.1 p90 -99.24 23.27 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -131.16 120.34 23.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 111.453 175.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.551 HG13 HD13 ' A' ' 7' ' ' ILE . 71.4 mt -106.21 111.43 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.4 mp -91.8 169.14 10.94 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.8 m . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.89 178.432 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.534 ' O ' HG23 ' A' ' 73' ' ' ILE . 7.0 Cg_exo . . . . . 0 N--CA 1.46 -0.447 0 CA-C-O 120.364 0.068 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.554 HD12 HG23 ' A' ' 94' ' ' ILE . 11.0 tp 178.32 26.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 121.951 0.881 . . . . 0.0 109.763 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.482 ' HA ' HD11 ' A' ' 98' ' ' ILE . 25.2 p-10 -142.48 38.22 1.52 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.567 -170.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 75.2 m-85 -96.64 165.64 12.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.945 0.402 . . . . 0.0 111.482 -175.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.524 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 14.3 m -64.37 138.17 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.194 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -51.28 -54.1 29.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.12 0.485 . . . . 0.0 109.774 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.4 t -59.34 -34.43 72.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.731 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' MET . 34.6 tt0 -71.79 -42.13 67.48 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.055 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 57' ' ' TYR . 80.8 mt -65.37 -40.9 94.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.325 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HG3' HG12 ' A' ' 91' ' ' ILE . 98.7 mttt -68.22 -17.17 64.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.033 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.54 11.14 42.64 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.237 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 45.9 mtt -89.13 162.19 16.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.0 111.528 -179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.739 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 45.6 t-20 -71.2 145.98 49.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.202 174.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 14.2 tmtt? -53.69 -39.35 65.08 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.603 177.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.99 -28.03 67.93 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.742 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.739 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 23.1 mm-40 -64.35 -50.16 68.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 74' ' ' ILE . 64.8 m-70 -55.45 -42.49 74.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.916 176.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.542 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 45.6 mt-10 -58.51 -51.56 69.34 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.388 0.43 . . . . 0.0 110.352 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m -55.03 -42.11 72.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.509 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.534 HG23 ' O ' ' A' ' 54' ' ' PRO . 88.2 mt -57.7 -60.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.509 178.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.707 HG12 ' O ' ' A' ' 70' ' ' HIS . 3.1 pt -76.24 -13.92 14.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -174.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.7 m -72.59 -45.22 60.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -74.39 -30.2 61.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.524 HD22 HD13 ' A' ' 55' ' ' ILE . 33.4 tp -67.63 -34.2 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.41 36.06 3.67 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.17 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.555 ' HB3' ' HB ' ' A' ' 74' ' ' ILE . 30.7 tpt180 -115.55 -50.92 2.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.573 0.225 . . . . 0.0 110.523 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.6 t30 68.08 134.12 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.452 0 O-C-N 124.028 0.83 . . . . 0.0 111.16 -177.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.542 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 20.4 Cg_endo -81.05 61.98 8.39 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.457 2.105 . . . . 0.0 112.506 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.7 p -86.42 -17.81 33.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.549 -179.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -149.77 81.76 1.39 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 110.607 175.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 81' ' ' PRO . 85.3 m-85 -142.27 108.57 5.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.15 174.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -102.67 -28.07 12.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.084 -175.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.594 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 84.0 m-20 -107.11 152.69 23.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.757 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.58 -37.65 73.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -55.16 -41.49 71.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.707 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.594 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 48.2 mm-40 -59.88 -45.42 92.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.171 177.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -62.53 -46.79 86.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 63' ' ' LYS . 1.9 mp -66.52 -40.38 86.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.421 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.15 -40.53 90.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.493 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -71.04 -37.3 72.55 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.851 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.554 HG23 HD12 ' A' ' 55' ' ' ILE . 64.1 mt -70.72 -37.95 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.552 179.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.467 HD13 HD12 ' A' ' 98' ' ' ILE . 3.9 mm? -71.98 -18.71 61.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.133 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -60.9 -43.73 98.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -69.95 -37.35 75.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.661 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.482 HD11 ' HA ' ' A' ' 56' ' ' ASN . 64.2 mt -64.34 -41.61 92.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.56 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.606 176.934 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.418 ' O ' ' HA ' ' A' ' 26' ' ' THR . 56.0 m-85 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 25' ' ' GLN . 14.3 p -113.59 123.08 49.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.956 0.408 . . . . 0.0 110.823 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.98 135.06 49.19 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.136 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 28.7 ttpp -126.53 122.78 36.11 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.42 -178.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -63.95 117.4 6.96 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.745 HG13 ' HG3' ' A' ' 8' ' ' LYS . 33.7 pt -106.12 -27.21 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.593 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.745 ' HG3' HG13 ' A' ' 7' ' ' ILE . 29.9 mtpp -117.36 100.58 7.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.334 -177.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.8 -120.92 1.82 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.567 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.486 ' HG3' ' H ' ' A' ' 11' ' ' THR . 20.8 pttp -176.21 -56.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -174.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.486 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.5 p -142.21 119.22 11.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.206 -178.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -154.51 124.2 6.61 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.55 135.92 49.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.998 0.428 . . . . 0.0 110.631 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 35' ' ' LEU . 58.5 t -107.3 107.03 21.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.944 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.9 mtt 65.66 -75.25 0.05 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.972 0.795 . . . . 0.0 111.334 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -138.76 -3.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.82 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -101.15 115.32 42.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -91.05 112.14 23.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.155 -174.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.44 153.81 19.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.269 0.556 . . . . 0.0 111.322 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -131.79 150.98 51.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.427 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -57.91 111.65 1.23 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.769 0.319 . . . . 0.0 110.841 175.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.76 -8.66 43.35 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.543 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -104.3 119.39 53.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.809 0.338 . . . . 0.0 110.654 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.549 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 20.4 p -102.72 123.08 45.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.204 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 3' ' ' THR . 48.9 mt-30 -127.65 157.78 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.655 0.265 . . . . 0.0 111.134 -178.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 0.8 OUTLIER -71.83 128.81 36.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.605 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 34.1 m -123.95 145.84 49.14 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.684 178.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.553 ' HD2' HD12 ' A' ' 31' ' ' LEU . 26.0 Cg_exo -63.5 156.89 53.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.711 2.274 . . . . 0.0 111.356 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -53.94 -36.07 62.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.53 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.45 -44.68 95.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.553 HD12 ' HD2' ' A' ' 28' ' ' PRO . 76.4 mt -78.26 -26.81 47.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.764 0.316 . . . . 0.0 110.613 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -57.63 -48.33 79.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.391 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -77.1 -30.76 55.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.041 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -61.31 -46.15 91.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.107 176.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.418 HD21 HG21 ' A' ' 14' ' ' VAL . 82.8 mt -77.97 -19.55 54.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.247 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -65.53 -28.08 68.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.31 0.576 . . . . 0.0 110.079 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -90.64 10.64 24.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.951 176.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 46.0 m-80 -135.02 97.44 13.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.359 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -71.81 28.07 0.24 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.788 2.992 . . . . 0.0 114.904 -169.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.7 p90 -112.37 9.65 19.81 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.484 -0.487 . . . . 0.0 111.044 175.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.416 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 42.9 m-85 -123.64 140.99 52.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.342 171.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.8 tt -97.18 126.66 49.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 171.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.01 103.98 13.63 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.623 -174.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.9 m . . . . . 0 C--N 1.318 -0.8 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.417 -177.397 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.483 ' O ' HG22 ' A' ' 55' ' ' ILE . 98.3 Cg_endo . . . . . 0 N--CA 1.46 -0.485 0 N-CA-C 113.121 0.393 . . . . 0.0 113.121 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.517 HD11 ' HG3' ' A' ' 97' ' ' GLN . 7.2 tp 52.61 25.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.433 1.093 . . . . 0.0 111.738 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -157.02 92.66 1.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.988 -175.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -142.77 159.95 41.26 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 60' ' ' SER . 3.2 m -67.98 145.03 54.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.055 174.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.426 ' HB2' HD11 ' A' ' 95' ' ' LEU . 2.4 tm-20 -56.54 -31.64 64.34 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 171.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 58' ' ' THR . 14.9 m -60.05 -38.75 83.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.456 172.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.26 -36.25 24.69 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.21 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.0 mt -72.76 -16.86 61.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.41 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.594 ' HD2' HD13 ' A' ' 91' ' ' ILE . 0.6 OUTLIER -63.45 -36.03 82.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.453 176.663 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.43 -135.23 5.2 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.068 -176.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm 61.77 -166.88 0.21 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 122.896 0.478 . . . . 0.0 110.124 -173.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -106.26 162.2 13.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.453 ' HE2' ' HB2' ' A' ' 67' ' ' LYS . 3.5 mppt? -69.63 -33.44 72.63 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 121.343 -0.143 . . . . 0.0 110.73 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.37 -46.04 46.63 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.793 0.683 . . . . 0.0 112.394 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.6 mp0 -57.63 -55.99 27.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 110.068 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.537 ' HA ' HD12 ' A' ' 73' ' ' ILE . 69.3 m-70 -55.58 -47.75 75.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.998 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.49 -50.97 70.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.424 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.4 m -56.93 -37.83 72.03 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.316 0.579 . . . . 0.0 110.825 -178.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.537 HD12 ' HA ' ' A' ' 70' ' ' HIS . 88.0 mt -60.8 -60.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.544 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -70.18 -29.04 38.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.113 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.508 ' HA ' ' OD1' ' A' ' 80' ' ' ASN . 13.6 p -67.17 -32.78 74.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.839 0.352 . . . . 0.0 110.659 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -87.46 -18.05 30.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.878 0.37 . . . . 0.0 110.942 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.8 -37.75 67.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.045 175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 126.25 -13.71 7.02 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.208 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.459 ' O ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -113.93 80.35 1.37 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.206 0.527 . . . . 0.0 110.244 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.508 ' OD1' ' HA ' ' A' ' 75' ' ' SER . 77.2 m-20 -52.64 139.72 39.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.101 178.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' ' HB2' ' A' ' 84' ' ' PHE . 61.1 Cg_endo -75.3 51.19 2.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.976 2.451 . . . . 0.0 113.006 -178.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.6 m -71.13 -51.06 27.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.874 0.369 . . . . 0.0 110.504 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -100.37 -6.22 26.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.122 0.486 . . . . 0.0 110.429 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 81' ' ' PRO . 97.2 m-85 -90.79 108.66 19.97 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -145.2 -39.21 0.25 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.137 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.75 139.96 57.84 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.562 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' ARG . . . -52.55 -52.89 52.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -74.63 -25.5 59.27 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.691 -174.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.84 -39.84 76.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.438 0.637 . . . . 0.0 109.978 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 87' ' ' ALA . 12.1 ttm180 -54.48 -54.2 44.07 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.417 174.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.594 HD13 ' HD2' ' A' ' 63' ' ' LYS . 47.4 mt -61.67 -42.66 95.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.685 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.11 74.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.867 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -65.45 -48.17 73.62 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.865 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.27 -34.91 72.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.511 -176.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' A' ' 59' ' ' GLU . 29.2 mt -65.7 -39.45 91.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.008 176.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -68.63 -17.34 64.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.199 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.517 ' HG3' HD11 ' A' ' 55' ' ' ILE . 29.8 mm-40 -73.43 -24.8 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 176.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -86.59 -47.19 16.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.348 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.395 -179.732 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.882 0.373 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.401 ' CG2' ' HB3' ' A' ' 24' ' ' SER . 12.5 m -138.62 127.47 23.71 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.381 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.95 138.88 44.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HD3' ' OG ' ' A' ' 24' ' ' SER . 34.9 ttpt -129.79 116.51 18.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -65.9 124.96 23.91 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.728 HG13 ' HG3' ' A' ' 8' ' ' LYS . 18.7 pt -117.18 -38.31 2.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.369 . . . . 0.0 111.319 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.728 ' HG3' HG13 ' A' ' 7' ' ' ILE . 61.5 mtpt -100.67 90.66 4.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.058 0.456 . . . . 0.0 110.243 -177.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.43 -137.22 6.47 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.697 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 10' ' ' LYS . 46.0 mtpt -154.25 -55.62 0.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.1 m -149.88 131.86 15.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.058 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -143.21 123.68 13.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.1 -177.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -85.17 117.58 24.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.93 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.0 t -114.41 106.25 20.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 176.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.73 -91.37 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.845 -177.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.98 6.79 6.43 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.8 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.467 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.0 mp -108.89 129.74 62.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -98.61 105.81 18.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.97 0.414 . . . . 0.0 110.878 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -87.49 143.51 27.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.487 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -133.9 144.22 48.74 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.288 178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -50.02 119.32 3.5 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.628 0.58 . . . . 0.0 112.033 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 -4.67 63.48 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.591 -0.731 . . . . 0.0 113.266 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -106.74 114.15 45.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 117.112 0.456 . . . . 0.0 111.669 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.406 ' OG ' ' HD3' ' A' ' 5' ' ' LYS . 41.4 m -79.12 130.97 36.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.107 171.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -129.78 139.3 51.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.772 0.32 . . . . 0.0 110.76 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -72.62 108.61 5.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 m -109.37 154.68 42.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.175 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.531 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.2 Cg_exo -67.37 164.39 30.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.955 2.436 . . . . 0.0 111.866 174.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -58.01 -40.04 79.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.564 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.47 -48.91 73.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.463 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD12 ' HD2' ' A' ' 28' ' ' PRO . 59.1 mt -67.47 -27.37 66.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.171 -176.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -58.9 -48.38 81.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.847 0.356 . . . . 0.0 110.137 175.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.39 -37.36 63.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.749 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 80.5 t80 -55.82 -42.98 76.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.734 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.504 HD22 ' CE1' ' A' ' 41' ' ' PHE . 87.2 mt -85.75 -18.96 31.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.991 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -61.48 -30.86 70.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.347 0.594 . . . . 0.0 109.838 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -82.81 -0.52 48.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.745 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -121.23 114.43 31.98 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.897 0.379 . . . . 0.0 110.951 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -78.16 44.58 1.62 Allowed 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 123.149 2.566 . . . . 0.0 113.542 -173.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -105.16 -15.53 15.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 110.297 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.504 ' CE1' HD22 ' A' ' 35' ' ' LEU . 35.9 m-85 -123.08 153.45 39.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.402 -167.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.577 HG12 HD13 ' A' ' 7' ' ' ILE . 25.9 mm -101.57 108.61 23.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 162.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -90.02 118.64 29.72 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.278 0.561 . . . . 0.0 110.083 -177.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 m . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.211 -175.701 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.512 ' O ' HG22 ' A' ' 55' ' ' ILE . 84.6 Cg_endo . . . . . 0 N--CA 1.45 -1.041 0 N-CA-C 112.912 0.312 . . . . 0.0 112.912 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.813 HG21 HD13 ' A' ' 77' ' ' LEU . 3.8 tp 59.41 23.75 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 115.305 -0.861 . . . . 0.0 113.049 169.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -136.64 38.49 2.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.211 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.479 ' HB2' HD21 ' A' ' 62' ' ' LEU . 68.6 m-85 -94.92 155.94 16.55 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.569 -178.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.573 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -57.53 127.01 29.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.748 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.748 ' HB3' ' HG ' ' A' ' 95' ' ' LEU . 1.9 pp20? -62.79 -26.19 68.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.142 0.496 . . . . 0.0 110.289 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 p -71.59 -30.73 66.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.948 174.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 30.3 mm-40 -79.49 -40.7 29.12 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.561 175.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD21 ' HB2' ' A' ' 57' ' ' TYR . 92.3 mt -62.96 -20.93 65.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.153 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.614 ' HD3' HD13 ' A' ' 91' ' ' ILE . 0.1 OUTLIER -64.69 -33.46 76.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.916 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.95 -24.04 13.9 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.536 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 24.1 mmt -53.89 138.51 36.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.919 0.39 . . . . 0.0 110.99 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -84.47 -174.79 5.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.298 0.57 . . . . 0.0 111.836 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 63.2 tttm -59.34 -54.41 47.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.421 -178.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.59 84.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.795 -174.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 73' ' ' ILE . 49.1 mt-10 -63.99 -51.46 64.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.517 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.561 ' O ' HG13 ' A' ' 74' ' ' ILE . 26.7 m-70 -55.31 -43.11 74.56 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.095 175.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.575 ' HG2' ' HG2' ' A' ' 81' ' ' PRO . 46.0 mt-10 -60.17 -45.23 93.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.963 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -65.21 -45.04 86.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.744 0.307 . . . . 0.0 110.475 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 69' ' ' GLU . 97.8 mt -55.37 -56.54 11.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.993 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.1 mt -75.02 -25.75 18.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.065 -172.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.9 m -71.56 -27.18 62.98 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.111 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -69.88 -33.25 71.97 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 171.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.813 HD13 HG21 ' A' ' 55' ' ' ILE . 42.3 tp -67.17 -37.64 84.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.182 173.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 123.03 22.4 2.4 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.877 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -146.74 126.09 13.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 111.217 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 17.2 m120 -80.09 137.6 53.18 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.122 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.575 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 8.7 Cg_endo -84.39 48.68 2.52 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.599 2.199 . . . . 0.0 112.237 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.1 p -85.95 -36.08 20.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.656 175.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -66.3 -35.56 80.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.128 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -96.03 108.65 21.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.302 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -94.45 -26.41 16.49 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.993 0.425 . . . . 0.0 110.783 -174.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.507 ' HB3' ' CD ' ' A' ' 89' ' ' GLU . 3.7 t-20 -99.09 151.34 21.07 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.107 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -65.36 -32.68 74.44 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -177.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.38 -55.63 32.31 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.589 0.233 . . . . 0.0 111.386 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.507 ' CD ' ' HB3' ' A' ' 86' ' ' ASN . 1.1 pm0 -60.5 -34.25 73.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.284 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.429 ' O ' HG13 ' A' ' 94' ' ' ILE . 97.5 mtt180 -64.6 -44.24 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.429 177.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.614 HD13 ' HD3' ' A' ' 63' ' ' LYS . 80.7 mt -66.05 -44.87 91.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.127 177.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.33 96.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.5 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 49.2 t80 -64.4 -42.36 96.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.455 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -69.73 -40.79 79.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 0.0 110.134 177.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.748 ' HG ' ' HB3' ' A' ' 59' ' ' GLU . 0.5 OUTLIER -57.66 -46.1 84.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.813 -179.623 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -76.42 -3.84 39.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -174.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.673 ' HG3' HG12 ' A' ' 55' ' ' ILE . 76.3 mm-40 -80.17 -30.15 38.8 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.4 mt -74.72 -34.88 35.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.591 174.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.779 178.965 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 mmt . . . . . 0 N--CA 1.48 1.05 0 CA-C-O 120.567 0.222 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 40.4 m-85 -105.17 142.24 35.3 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.7 t -144.14 146.23 32.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.969 0.414 . . . . 0.0 110.604 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.54 145.68 51.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.389 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -134.78 129.62 34.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.915 178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.784 HD22 ' H ' ' A' ' 9' ' ' GLY . 2.8 mt -64.09 117.8 7.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.629 -177.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.494 HG21 ' HB ' ' A' ' 42' ' ' ILE . 42.5 pt -108.39 -28.51 2.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.15 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 40' ' ' TYR . 49.1 tptt -88.91 -34.33 16.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.11 -177.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.784 ' H ' HD22 ' A' ' 6' ' ' LEU . . . -105.13 -157.77 23.06 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.672 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 73.3 mmtt -139.9 -41.76 0.43 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.464 HG23 ' HG2' ' A' ' 20' ' ' ARG . 25.4 m -152.34 114.4 4.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.88 172.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CB ' HD11 ' A' ' 6' ' ' LEU . 29.6 t80 -136.31 139.14 42.39 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.685 0.278 . . . . 0.0 110.358 -172.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -106.95 112.39 25.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.962 0.411 . . . . 0.0 110.271 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 35' ' ' LEU . 78.8 t -102.09 104.34 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 45.2 ttm 65.71 -79.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.742 0.651 . . . . 0.0 110.668 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.38 10.92 2.74 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.1 mm -108.03 139.63 29.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 m -108.95 113.27 26.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.929 0.395 . . . . 0.0 111.137 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -107.4 148.86 28.56 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.239 178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 11' ' ' THR . 31.2 mtp85 -133.01 143.29 49.32 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 175.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 9' ' ' GLY . . . -55.28 127.21 28.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.955 0.407 . . . . 0.0 111.317 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.83 -13.28 67.79 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.162 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -103.77 113.49 40.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.703 0.287 . . . . 0.0 110.842 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.3 m -85.53 136.3 33.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 174.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -138.05 134.32 34.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -70.39 130.55 42.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.52 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 34.0 m -126.74 155.43 75.14 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.881 -178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.543 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.2 Cg_exo -70.88 166.69 28.15 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.855 2.37 . . . . 0.0 111.469 173.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -56.7 -36.91 70.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.978 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -56.33 -51.16 69.27 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.035 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.543 HD12 ' HD2' ' A' ' 28' ' ' PRO . 83.0 mt -73.77 -30.11 62.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.044 -176.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -59.16 -46.85 87.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.584 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -80.55 -27.2 37.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.064 -179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.33 -41.76 98.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 173.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.462 HD22 ' CE1' ' A' ' 41' ' ' PHE . 79.4 mt -85.33 -8.21 58.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.605 177.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.431 ' HA ' HD11 ' A' ' 43' ' ' LEU . 15.4 t30 -72.12 -32.2 66.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 172.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -75.98 -39.03 56.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.728 172.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.601 ' HB3' ' HD1' ' A' ' 40' ' ' TYR . 33.1 m-80 -86.44 108.9 19.69 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.548 -175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.18 44.84 1.68 Allowed 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.072 2.514 . . . . 0.0 113.541 -174.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.601 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 63.0 m-85 -102.41 -16.65 16.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 110.951 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.497 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 64.4 m-85 -125.35 158.84 33.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.004 0.431 . . . . 0.0 111.61 -169.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.494 ' HB ' HG21 ' A' ' 7' ' ' ILE . 15.8 tt -97.05 131.64 43.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 165.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.431 HD11 ' HA ' ' A' ' 36' ' ' ASN . 69.8 mt -108.58 134.41 51.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.398 0.618 . . . . 0.0 111.091 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.7 m -144.43 133.35 22.6 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.69 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -127.4 130.11 48.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.918 0.389 . . . . 0.0 110.044 175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.15 151.74 51.97 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.572 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.12 106.08 16.42 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.814 -177.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -74.49 -36.99 63.28 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.756 HD21 ' HB2' ' A' ' 52' ' ' ASP . 28.5 t-20 -87.42 88.7 7.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.666 175.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -76.8 -55.15 5.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.01 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -136.9 121.45 18.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.748 176.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.756 ' HB2' HD21 ' A' ' 49' ' ' ASN . 6.1 t70 -112.18 -156.54 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 172.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -96.74 98.95 4.96 Favored Pre-proline 0 C--N 1.318 -0.793 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' A' ' 76' ' ' ASN . 56.6 Cg_endo -89.33 76.41 1.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 123.06 2.507 . . . . 0.0 112.701 -171.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.758 HG12 HD22 ' A' ' 77' ' ' LEU . 8.5 tp -169.65 27.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 122.247 1.022 . . . . 0.0 109.438 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -160.54 109.43 1.67 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.016 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -142.07 174.84 10.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.497 -176.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -64.17 129.43 39.94 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 175.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.3 pp20? -60.27 -31.32 70.11 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -62.02 -37.95 86.85 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.119 174.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -29.6 42.84 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 120.566 -0.453 . . . . 0.0 110.39 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 65' ' ' MET . 92.1 mt -79.9 -20.25 46.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.102 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 30.2 mmtp -68.04 -30.96 70.31 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.278 0.561 . . . . 0.0 109.962 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -110.49 26.17 13.77 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.621 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.595 ' HG3' ' HB2' ' A' ' 69' ' ' GLU . 44.0 tpp -104.29 135.48 45.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.703 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 5.6 m-20 -71.92 170.03 14.62 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.782 0.801 . . . . 0.0 112.958 -171.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -58.21 8.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.769 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.45 -24.66 65.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.916 0.389 . . . . 0.0 111.126 -175.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.703 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 8.7 mm-40 -65.04 -54.08 35.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.998 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.527 ' O ' HG13 ' A' ' 74' ' ' ILE . 44.0 m-70 -53.66 -40.66 66.08 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 176.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.97 -49.22 62.95 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.623 -176.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 p -61.08 -35.83 78.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.63 0.252 . . . . 0.0 110.874 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 69' ' ' GLU . 94.0 mt -55.7 -61.6 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.104 0.478 . . . . 0.0 110.91 175.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.63 ' HA ' HD13 ' A' ' 55' ' ' ILE . 5.7 mt -70.93 -21.38 22.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.026 -173.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 57.9 m -67.7 -35.08 78.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.843 0.354 . . . . 0.0 110.237 174.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.562 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 17.9 m-80 -72.13 -28.32 63.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.406 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.758 HD22 HG12 ' A' ' 55' ' ' ILE . 42.0 tp -64.43 -34.86 79.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.349 172.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 19.43 10.5 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.924 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 159.64 20.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -95.23 107.16 30.49 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.852 0.358 . . . . 0.0 110.627 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.525 ' HB3' HD12 ' A' ' 74' ' ' ILE . 83.9 Cg_endo -82.91 12.78 2.83 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.333 . . . . 0.0 112.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.6 p -77.89 -25.74 48.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.24 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.77 -37.54 59.16 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.087 0.47 . . . . 0.0 109.879 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -81.98 108.59 15.6 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -105.29 -29.59 10.2 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -170.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -89.68 153.24 20.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.84 0.353 . . . . 0.0 110.601 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.8 91.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -54.64 -48.79 71.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.94 -50.51 73.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.409 0.623 . . . . 0.0 110.807 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -67.24 -39.94 86.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.016 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.403 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.3 mt -70.05 -44.24 78.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.681 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.02 -42.4 99.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 0.0 111.335 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.24 -40.55 96.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.51 -34.89 71.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 178.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.632 ' O ' HG22 ' A' ' 98' ' ' ILE . 53.3 mt -67.36 -23.7 65.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.567 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -30.18 71.3 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.318 176.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 55' ' ' ILE . 2.7 mp0 -88.27 -25.07 23.01 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.395 -178.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 95' ' ' LEU . 8.3 tp -70.47 -22.18 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 173.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -81.53 -25.09 36.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.625 -1.17 . . . . 0.0 110.405 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 97' ' ' GLN . 5.9 m-80 -78.59 -19.81 51.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.238 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -83.14 81.62 8.61 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 170.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.02 -40.91 4.75 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.055 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -134.06 155.95 49.11 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.331 0.586 . . . . 0.0 111.803 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -126.02 -58.57 1.37 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.588 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -93.06 72.98 4.7 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.778 175.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -87.5 5.85 37.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.627 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -89.12 147.33 24.27 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.579 -176.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 22.2 p-80 -77.0 175.2 9.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.525 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 67.63 9.24 6.92 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.525 0.679 . . . . 0.0 110.431 -176.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.31 62.67 0.76 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.136 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 80.2 t60 . . . . . 0 C--O 1.245 0.857 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.64 -175.179 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.637 ' HB2' ' HB2' ' A' ' 46' ' ' GLU . 81.3 mtp . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 120.568 0.223 . . . . 0.0 110.633 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -97.87 103.46 15.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 85.1 m -112.74 130.36 56.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.205 0.526 . . . . 0.0 111.314 -174.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -114.21 146.1 40.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.176 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.408 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 36.1 ttpt -133.97 129.62 36.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.387 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -67.78 118.94 11.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.677 HG13 ' HG3' ' A' ' 8' ' ' LYS . 38.4 pt -109.25 -25.66 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.591 -176.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.677 ' HG3' HG13 ' A' ' 7' ' ' ILE . 99.2 mttt -122.06 96.79 5.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 0.0 111.115 -177.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.22 -118.52 0.99 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.878 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 2.2 ttmp? -175.61 -58.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.469 HG22 ' HG2' ' A' ' 20' ' ' ARG . 4.0 p -141.26 118.11 11.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.28 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -136.35 133.41 36.79 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.918 0.389 . . . . 0.0 110.634 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -97.24 110.5 23.03 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.892 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.83 92.01 3.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 173.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 35.1 mtm 62.78 -86.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.688 -176.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -124.23 12.54 8.02 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.536 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.8 mp -120.46 125.3 73.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.734 0.267 . . . . 0.0 110.478 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 86.4 m -89.95 109.36 20.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.516 175.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.469 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 81.0 m-85 -92.83 131.2 38.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.995 176.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HG2' HG22 ' A' ' 11' ' ' THR . 80.7 mtt180 -114.79 143.72 44.63 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.224 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.22 115.03 2.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.184 178.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.16 -9.49 59.58 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.837 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.9 t -100.72 115.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.881 0.372 . . . . 0.0 110.969 -178.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m -84.95 136.32 33.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.308 176.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.415 ' C ' HG23 ' A' ' 3' ' ' THR . 97.4 mt-30 -141.08 128.21 20.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.208 -177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.5 m -72.72 127.13 31.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.821 0.343 . . . . 0.0 110.273 178.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 m -118.68 163.43 25.81 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.685 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.7 Cg_exo -69.09 155.76 67.16 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.445 2.096 . . . . 0.0 110.576 169.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -63.94 -24.24 67.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.565 0.221 . . . . 0.0 111.275 -175.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -55.21 -41.45 72.04 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.12 0.486 . . . . 0.0 110.275 171.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.9 mt -84.32 -21.93 30.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.84 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.19 -47.38 80.02 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.95 -36.64 75.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.506 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -63.86 -39.88 95.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.842 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.7 mt -85.15 -12.08 53.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 178.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -68.26 -33.54 74.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 170.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -73.96 -15.1 61.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.953 175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -122.44 86.43 48.47 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -71.91 13.59 0.48 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 123.367 2.711 . . . . 0.0 114.611 -168.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.54 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 15.5 p90 -90.93 14.83 12.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.467 0.651 . . . . 0.0 110.515 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.471 ' CE1' HD22 ' A' ' 35' ' ' LEU . 88.8 m-85 -118.26 148.4 42.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.702 169.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.478 ' HB ' HG21 ' A' ' 7' ' ' ILE . 16.5 tt -97.45 129.88 46.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -107.34 114.63 28.79 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.234 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.6 m -126.45 126.49 43.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.64 -176.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -89.91 124.64 34.88 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.088 177.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.637 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 42.8 mt-10 -101.58 117.21 34.45 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 83.7 mt -119.41 99.9 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.337 -174.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 58.5 t30 74.45 146.9 0.09 Allowed 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.054 0.846 . . . . 0.0 112.386 171.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -122.71 -22.1 5.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.26 178.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -91.62 107.73 19.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.2 -173.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.4 tttm -120.78 58.22 0.95 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.477 0.656 . . . . 0.0 109.946 168.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -93.93 16.87 13.3 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 168.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 63.66 81.05 0.23 Allowed Pre-proline 0 C--O 1.232 0.18 0 CA-C-N 113.665 -1.607 . . . . 0.0 109.439 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.641 ' O ' HG23 ' A' ' 73' ' ' ILE . 94.8 Cg_endo -77.41 37.72 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.615 2.877 . . . . 0.0 113.071 -172.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.4 tp -145.06 24.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 122.395 1.093 . . . . 0.0 108.084 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -144.66 94.42 2.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.876 -173.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.595 ' HB2' HD11 ' A' ' 62' ' ' LEU . 77.3 m-85 -141.51 160.6 39.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.235 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.524 HG22 ' H ' ' A' ' 60' ' ' SER . 9.4 m -65.45 126.52 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.005 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -64.61 -26.91 68.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.222 0.534 . . . . 0.0 109.642 177.845 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 58' ' ' THR . 9.2 m -68.72 -30.05 68.6 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.609 175.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 13.3 mm-40 -82.1 -44.21 16.82 Favored 'General case' 0 C--O 1.227 -0.103 0 CA-C-O 120.948 0.404 . . . . 0.0 110.341 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 57' ' ' TYR . 88.1 mt -69.03 -12.69 61.91 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.549 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.7 OUTLIER -67.78 -53.61 25.82 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.472 -178.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.67 57.96 1.89 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.734 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.435 ' HG3' ' HA ' ' A' ' 62' ' ' LEU . 12.0 mmt -120.0 -169.49 1.79 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.583 0.706 . . . . 0.0 111.42 -177.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.482 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 39.0 t30 -100.14 -166.35 1.32 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.657 -1.156 . . . . 0.0 108.829 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' H ' ' CG ' ' A' ' 66' ' ' ASN . 1.4 ttpm? -100.6 -36.98 8.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.767 0.317 . . . . 0.0 110.561 176.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.505 ' HA ' ' OE1' ' A' ' 71' ' ' GLU . . . -62.78 -36.45 83.14 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.0 OUTLIER -74.7 -39.39 61.98 Favored 'General case' 0 C--O 1.22 -0.457 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.032 -176.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.539 ' HA ' HD12 ' A' ' 73' ' ' ILE . 64.6 m80 -56.1 -42.78 77.33 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 120.621 0.248 . . . . 0.0 110.814 172.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.558 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 42.0 mt-10 -60.72 -46.72 89.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.229 178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 76' ' ' ASN . 22.8 m -67.77 -31.42 71.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.126 178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 54' ' ' PRO . 30.7 mt -58.44 -57.6 10.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.527 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -86.64 -11.83 11.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.97 -171.735 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.7 p -81.03 -34.57 32.73 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 72' ' ' SER . 4.4 t-20 -65.18 -34.58 78.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.608 0.718 . . . . 0.0 109.265 174.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.416 HD21 ' OE1' ' A' ' 97' ' ' GLN . 53.4 tp -63.25 -25.16 68.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.997 175.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.97 11.29 60.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.241 -177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.613 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 1.6 tpm_? -93.0 -35.57 13.2 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 122.9 -0.177 . . . . 0.0 110.832 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 38.3 t30 70.45 108.96 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.721 0.638 . . . . 0.0 111.055 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.558 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 2.9 Cg_exo -75.16 65.17 6.21 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.953 2.435 . . . . 0.0 112.943 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 t -92.37 -29.21 16.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.389 . . . . 0.0 110.631 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -83.29 -23.96 32.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.259 0.552 . . . . 0.0 111.131 -177.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 59.5 m-85 -82.44 126.73 32.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.878 -172.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -108.76 -57.82 2.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.563 -176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -89.7 154.34 20.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.445 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.472 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -61.04 -30.82 70.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.648 0.261 . . . . 0.0 110.63 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -53.58 -54.29 39.51 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.311 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.41 -37.38 70.11 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.308 0.575 . . . . 0.0 110.634 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 94' ' ' ILE . 51.3 mtt-85 -68.25 -45.74 72.38 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.422 -178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 87' ' ' ALA . 75.4 mt -65.13 -43.67 95.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.621 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.5 80.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.484 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -71.26 -43.42 67.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.209 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 90' ' ' ARG . 91.7 mt -59.45 -43.03 89.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.133 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.525 HD23 HD12 ' A' ' 98' ' ' ILE . 19.1 mt -57.52 -39.04 75.68 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.281 174.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -68.33 -27.58 66.4 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.001 -174.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.54 HE21 ' N ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -83.37 -19.56 35.87 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.69 178.425 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.525 HD12 HD23 ' A' ' 95' ' ' LEU . 71.0 mt -67.48 -42.06 86.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 170.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -62.61 -40.73 97.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.684 174.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -90.44 17.83 6.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.747 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -83.12 80.35 9.08 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.1 61.72 4.09 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.857 -175.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -98.2 21.27 11.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.755 0.788 . . . . 0.0 109.193 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.622 ' HA ' ' HB2' ' A' ' 108' ' ' HIS . 78.6 mt -84.3 76.48 10.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.651 -178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -86.17 94.37 9.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.978 178.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.415 ' O ' ' HB2' ' A' ' 107' ' ' HIS . 66.3 m-70 52.3 58.05 5.81 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.405 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 106' ' ' HIS . 32.5 m170 70.81 110.36 0.06 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.307 -174.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.622 ' HB2' ' HA ' ' A' ' 104' ' ' LEU . 16.1 t-80 -81.82 93.48 6.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.653 -175.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -167.33 -21.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.781 -178.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 77.24 109.49 0.08 Allowed 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.781 0.675 . . . . 0.0 112.076 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.0 173.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptt? . . . . . 0 N--CA 1.481 1.101 0 CA-C-O 120.782 0.325 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.518 ' O ' ' HA ' ' A' ' 26' ' ' THR . 76.3 m-85 -134.85 153.03 52.21 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.495 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -104.69 122.27 45.31 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.963 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.65 133.0 56.41 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.1 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -132.35 133.97 44.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.237 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.567 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 2.8 mt -67.07 125.36 25.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.157 175.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.661 HG13 ' HG3' ' A' ' 8' ' ' LYS . 32.0 pt -111.64 -15.77 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.109 0.481 . . . . 0.0 110.676 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.661 ' HG3' HG13 ' A' ' 7' ' ' ILE . 67.5 mttm -130.14 134.0 47.01 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.298 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.96 -124.44 7.52 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.052 175.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -160.99 -59.64 0.05 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.975 0.416 . . . . 0.0 109.937 -171.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.498 HG23 ' HG2' ' A' ' 20' ' ' ARG . 32.6 m -153.08 121.15 6.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.278 -178.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -133.98 126.05 29.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -177.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -98.3 117.98 33.91 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.323 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.701 HG21 HD21 ' A' ' 35' ' ' LEU . 21.4 t -111.91 106.14 20.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.673 -178.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 38.1 tpp 71.38 -1.52 2.73 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.634 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.36 -29.0 3.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.65 -177.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.498 HD13 HD11 ' A' ' 31' ' ' LEU . 2.2 mp -82.44 119.93 32.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.0 m -90.01 114.79 26.71 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.078 -177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -100.08 143.18 30.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.015 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' A' ' 11' ' ' THR . 51.6 mtm180 -124.28 142.24 51.42 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 173.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -53.02 113.64 1.17 Allowed 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.426 0.454 . . . . 0.0 111.377 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.58 -13.99 27.5 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.927 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.1 t -104.69 111.31 33.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.964 0.382 . . . . 0.0 111.602 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.495 ' HB3' HG22 ' A' ' 3' ' ' THR . 20.1 m -79.43 137.03 37.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.586 173.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.22 151.83 44.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.518 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 7.6 p -82.97 124.01 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.187 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 21.3 m -118.37 154.34 52.06 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.927 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 27' ' ' VAL . 15.2 Cg_exo -73.56 173.51 13.75 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.773 2.982 . . . . 0.0 113.348 176.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -49.47 -46.6 48.27 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.667 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.8 mmtm -57.59 -53.8 54.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.095 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 45.5 mt -67.48 -33.88 76.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -175.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -59.69 -40.96 89.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -79.96 -38.37 32.45 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 121.417 0.627 . . . . 0.0 110.352 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -61.37 -39.77 91.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.274 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.701 HD21 HG21 ' A' ' 14' ' ' VAL . 91.6 mt -85.06 -19.12 32.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.714 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -62.06 -32.41 72.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.75 175.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -85.7 3.09 42.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.908 176.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -131.17 94.76 26.59 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.78 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.3 34.48 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.452 2.768 . . . . 0.0 114.621 -169.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.538 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.2 p90 -112.5 8.88 19.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.678 0.751 . . . . 0.0 110.515 172.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.453 ' CE2' ' HG ' ' A' ' 6' ' ' LEU . 61.1 m-85 -115.01 148.14 39.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.369 168.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.596 ' HB ' HG21 ' A' ' 7' ' ' ILE . 11.2 tp -96.99 122.77 48.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.254 170.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.9 mt -105.01 114.91 29.39 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.862 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.9 m -126.74 123.71 38.08 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.212 0.529 . . . . 0.0 110.512 -178.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.471 ' CD ' ' H ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -90.01 104.74 17.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.833 177.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.402 ' HB3' ' OD1' ' A' ' 49' ' ' ASN . 45.0 mt-10 -106.04 129.88 54.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.403 -177.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.07 113.45 12.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.596 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 69.26 13.69 8.56 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.344 -0.844 . . . . 0.0 112.097 173.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.402 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 9.7 m120 -91.07 147.94 22.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.905 0.383 . . . . 0.0 110.636 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -132.57 -149.82 0.39 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.362 -177.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -81.02 76.03 7.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.384 0.612 . . . . 0.0 109.977 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -84.02 95.74 8.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.511 176.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 2.3 m-20 -66.31 114.74 18.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.517 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.501 ' O ' HG22 ' A' ' 55' ' ' ILE . 5.4 Cg_exo -79.64 157.52 24.92 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.986 2.457 . . . . 0.0 111.988 177.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.534 HG12 HD22 ' A' ' 77' ' ' LEU . 7.6 tp 54.35 26.15 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.315 1.046 . . . . 0.0 112.163 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -148.54 88.42 1.63 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.146 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -142.64 152.62 42.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.947 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 1.016 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.4 m -59.29 130.89 49.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.411 175.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 16.9 pt-20 -61.88 -35.27 77.83 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.135 -178.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 p -66.57 -30.28 70.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 174.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 1.016 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 55.9 mm-40 -72.54 -39.55 67.41 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.61 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.536 HD23 ' SD ' ' A' ' 65' ' ' MET . 83.2 mt -74.86 -14.46 60.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.386 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 65.3 mmtt -65.12 -47.28 77.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.821 0.343 . . . . 0.0 110.649 177.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -95.31 53.94 1.8 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.494 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.536 ' SD ' HD23 ' A' ' 62' ' ' LEU . 95.7 mtp -138.09 162.01 35.29 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -94.87 168.54 10.74 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 20.6 pttp -74.28 -27.35 60.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -169.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.07 -49.48 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.2 mp0 -57.94 -51.49 69.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.707 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.505 ' O ' HG13 ' A' ' 74' ' ' ILE . 82.0 m-70 -49.89 -40.43 42.84 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.553 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 56.4 mt-10 -65.8 -45.33 82.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.209 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.7 p -74.09 -36.82 64.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.984 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.0 mt -55.09 -59.87 2.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 177.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.52 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 4.6 mt -76.84 -21.6 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.772 -173.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 71' ' ' GLU . 19.3 t -64.43 -33.58 76.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -72.96 -37.32 67.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.175 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.534 HD22 HG12 ' A' ' 55' ' ' ILE . 45.6 tp -59.06 -38.51 79.56 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.434 175.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.41 -43.72 0.87 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.28 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -101.18 107.19 18.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.776 0.322 . . . . 0.0 110.883 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -69.89 124.4 90.57 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.553 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 42.3 Cg_endo -69.05 73.9 1.01 Allowed 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.609 2.206 . . . . 0.0 114.021 -172.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.4 t -104.04 -20.85 13.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.25 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -87.96 8.73 24.98 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.39 0.614 . . . . 0.0 110.174 175.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -119.08 122.83 42.99 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -87.0 -58.9 2.42 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.779 -173.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -92.24 -179.91 5.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 111.434 -177.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.432 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -74.3 -36.59 63.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.679 -176.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -64.33 -38.03 89.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.262 -176.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -58.51 -39.54 80.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.472 ' O ' HG13 ' A' ' 94' ' ' ILE . 77.1 mtt85 -70.4 -40.42 73.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.756 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 87' ' ' ALA . 79.5 mt -63.37 -41.74 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.269 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.72 -44.67 96.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.219 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -63.91 -38.42 91.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.325 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.478 HG12 HD12 ' A' ' 55' ' ' ILE . 65.8 mt -65.54 -47.52 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 177.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 98' ' ' ILE . 30.4 mt -60.58 -36.37 78.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.953 0.406 . . . . 0.0 111.65 178.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.6 ttpt -63.35 -32.25 73.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.319 -175.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.23 -28.71 47.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.763 0.316 . . . . 0.0 110.786 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.502 HD12 HD23 ' A' ' 95' ' ' LEU . 63.9 mt -68.23 -40.31 82.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 109.685 175.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -71.18 -58.12 3.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.23 177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -86.71 74.08 9.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.161 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 102' ' ' GLY . 12.1 pttm -93.22 -67.51 0.85 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.531 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.417 ' H ' ' HG3' ' A' ' 101' ' ' LYS . . . 86.11 -42.82 3.18 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.803 -177.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -73.84 122.05 21.87 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.9 mp -85.38 110.61 19.25 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.962 0.411 . . . . 0.0 110.727 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -77.39 130.06 36.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.797 175.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -141.53 23.82 2.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -97.25 22.95 7.97 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -65.48 -20.27 66.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.995 -173.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -61.25 -13.23 17.1 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.852 0.358 . . . . 0.0 111.375 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.94 26.94 3.28 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.787 0.327 . . . . 0.0 110.465 175.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.808 -0.615 . . . . 0.0 110.167 -178.147 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -91.3 135.11 34.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.601 0.238 . . . . 0.0 111.072 -174.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.8 p -126.22 139.65 53.17 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.03 136.27 45.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.783 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 5.6 ptpp? -133.25 143.57 49.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.973 0.416 . . . . 0.0 110.775 177.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.691 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -70.76 140.56 51.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.503 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.535 HD13 HG13 ' A' ' 42' ' ' ILE . 43.1 pt -122.82 -43.93 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 67.8 mttm -94.89 94.09 7.83 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.038 0.447 . . . . 0.0 110.462 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.05 -116.04 0.98 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.103 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -179.03 -55.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.9 m -140.57 115.5 9.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.33 176.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -135.87 133.8 38.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 64.5 t30 -102.35 121.61 42.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.091 -176.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.6 t -108.55 106.64 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.214 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.5 mtt 64.48 -85.84 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.993 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -136.19 9.01 4.12 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 121.251 -0.499 . . . . 0.0 111.887 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.462 HD13 HD11 ' A' ' 31' ' ' LEU . 3.8 mp -118.59 112.76 39.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.6 m -88.56 122.94 32.56 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.039 0.447 . . . . 0.0 111.106 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -103.36 143.8 32.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.471 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -120.11 146.04 46.33 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.829 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.691 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.53 115.49 2.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.304 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.65 -16.59 60.23 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.693 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -103.28 110.97 31.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.79 0.328 . . . . 0.0 110.208 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.783 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 20.3 m -82.77 136.52 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.253 0.549 . . . . 0.0 111.877 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -114.54 149.41 36.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.436 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -81.68 119.28 23.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 27.7 m -119.44 152.7 53.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.832 0.349 . . . . 0.0 111.574 -173.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.443 ' HD2' HD12 ' A' ' 31' ' ' LEU . 13.3 Cg_exo -71.51 177.38 6.84 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.134 2.556 . . . . 0.0 112.087 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -60.0 -39.51 86.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.469 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -59.37 -52.82 63.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.313 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.538 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 67.3 mt -68.14 -28.91 67.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.393 -175.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 76.8 t80 -60.87 -52.9 63.1 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 177.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -73.47 -31.36 63.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.342 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -61.41 -50.39 73.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.595 ' HB2' HD21 ' A' ' 43' ' ' LEU . 80.1 mt -81.41 -16.9 50.73 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.841 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 56.5 t30 -69.49 -29.54 67.21 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.301 0.572 . . . . 0.0 109.67 175.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.18 -20.85 37.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.568 177.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -94.51 111.35 53.55 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.433 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.76 29.7 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.262 2.642 . . . . 0.0 114.554 -168.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.513 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.1 p90 -129.21 19.34 5.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.295 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -130.87 136.91 49.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.535 HG13 HD13 ' A' ' 7' ' ' ILE . 4.0 mt -97.8 124.63 50.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.595 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.5 mp -122.07 131.12 53.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.357 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.7 m -125.48 124.97 42.54 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.451 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.444 ' H ' ' HG3' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -89.76 113.28 24.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.232 0.539 . . . . 0.0 110.319 176.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -102.04 151.15 22.49 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.166 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.8 mp -82.56 166.96 18.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -112.32 -178.18 3.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -65.16 124.1 21.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.924 0.392 . . . . 0.0 111.07 -178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -85.6 168.64 14.27 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.486 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.2 119.62 24.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.161 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -82.32 88.91 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 4.2 t0 -53.89 110.65 2.2 Favored Pre-proline 0 N--CA 1.469 0.476 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.412 -171.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.628 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 57.2 Cg_endo -95.74 102.58 0.1 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.654 2.903 . . . . 0.0 113.334 -176.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.628 ' HB ' ' O ' ' A' ' 54' ' ' PRO . 10.9 tp 163.15 29.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 122.196 0.998 . . . . 0.0 108.569 177.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.525 ' HA ' HD13 ' A' ' 98' ' ' ILE . 27.3 t30 -158.33 89.48 0.98 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.092 -171.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -139.17 164.94 28.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.783 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 60' ' ' SER . 4.6 m -64.74 145.16 56.63 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 172.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -58.88 -37.56 76.86 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 174.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.417 ' H ' HG22 ' A' ' 58' ' ' THR . 16.5 m -63.68 -32.84 74.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.25 174.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -28.59 62.05 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.319 0.58 . . . . 0.0 110.378 177.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' HB3' HG12 ' A' ' 91' ' ' ILE . 91.4 mt -87.77 -18.82 28.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.259 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -71.06 -43.24 68.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.035 0.445 . . . . 0.0 110.527 175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -2.0 90.28 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.922 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.706 ' HG3' ' HG3' ' A' ' 69' ' ' GLU . 49.9 ttm -88.58 131.87 34.77 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 122.523 0.329 . . . . 0.0 110.34 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.473 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 22.9 m-80 -81.29 175.01 10.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.815 0.34 . . . . 0.0 111.113 -175.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.432 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 19.7 ptmt -67.73 -39.28 84.3 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.07 -53.14 61.43 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.032 0.444 . . . . 0.0 111.455 -174.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.706 ' HG3' ' HG3' ' A' ' 65' ' ' MET . 3.9 pm0 -65.63 -45.88 81.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.89 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.557 ' O ' HG13 ' A' ' 74' ' ' ILE . 17.4 m-70 -44.53 -53.17 7.31 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -68.02 -42.63 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.46 -176.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.2 m -61.15 -40.69 94.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.946 0.403 . . . . 0.0 110.848 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 69' ' ' GLU . 79.8 mt -59.21 -58.66 5.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.527 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.0 mt -70.8 -24.95 25.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.917 0.389 . . . . 0.0 111.13 -173.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.6 m -68.29 -30.18 69.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.785 0.326 . . . . 0.0 110.233 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -75.17 -26.13 58.84 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.384 175.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 74' ' ' ILE . 50.4 tp -63.02 -32.94 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.495 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.51 5.09 30.1 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.868 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -128.49 99.2 5.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -70.6 129.52 89.94 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.017 -173.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -83.98 43.89 1.46 Allowed 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 123.037 2.492 . . . . 0.0 112.11 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.8 t -70.41 -30.16 66.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.153 -176.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.19 -18.06 35.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 110.588 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -85.47 118.38 24.96 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -111.62 -19.18 12.6 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.86 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 3.5 m-20 -97.45 145.26 26.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.399 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.01 -33.5 75.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.16 -177.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.42 -39.67 77.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.474 ' CD ' ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp0 -60.65 -33.8 73.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.966 0.413 . . . . 0.0 110.274 175.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 71.6 mtt-85 -67.07 -40.6 87.05 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 62' ' ' LEU . 97.0 mt -63.15 -45.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.75 93.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.592 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -70.4 -39.43 74.51 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.635 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -67.79 -34.71 69.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 98' ' ' ILE . 12.8 mt -64.67 -28.62 69.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.887 177.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 96' ' ' LYS . 5.0 tmtm? -77.21 -28.24 53.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.017 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -6.73 58.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.002 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 56' ' ' ASN . 48.0 mm -57.02 -40.27 71.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.674 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -64.46 -49.86 69.77 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.935 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -61.84 -46.35 89.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.714 -173.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.607 ' HE3' HG21 ' A' ' 55' ' ' ILE . 66.2 mmtt -80.73 -55.99 4.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.705 -175.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 62.66 -105.93 1.13 Allowed Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.893 -176.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -161.75 163.93 29.28 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 mp -86.32 144.13 27.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 179.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.544 ' HG3' ' H ' ' A' ' 107' ' ' HIS . 11.6 tp10 -70.19 133.65 47.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.941 177.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -104.97 26.44 9.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.26 -175.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.544 ' H ' ' HG3' ' A' ' 105' ' ' GLU . 4.9 t-80 -62.97 105.72 0.72 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.269 0.557 . . . . 0.0 109.832 -178.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -97.32 147.81 23.78 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.578 -171.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -116.85 86.69 2.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.791 -177.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.407 ' HB3' ' H ' ' A' ' 111' ' ' HIS . 0.1 OUTLIER -176.39 -84.4 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -176.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.407 ' H ' ' HB3' ' A' ' 110' ' ' HIS . 55.9 t-80 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.391 -0.814 . . . . 0.0 109.036 176.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.436 ' O ' ' HA ' ' A' ' 45' ' ' GLN . 26.4 ptt? . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -106.2 111.36 23.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.425 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.541 ' HB ' ' HB3' ' A' ' 24' ' ' SER . 17.5 p -108.5 131.67 54.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.026 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.79 148.62 28.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.155 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -147.13 132.43 18.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.2 -174.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 6' ' ' LEU . 2.6 mm? -65.31 125.53 25.34 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.777 175.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.885 HD12 ' HG3' ' A' ' 8' ' ' LYS . 2.7 pp -109.72 -4.63 10.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.416 0.626 . . . . 0.0 110.36 175.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.885 ' HG3' HD12 ' A' ' 7' ' ' ILE . 61.8 mttm -138.11 127.38 24.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.997 173.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.69 -128.73 8.44 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.311 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -172.68 -48.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 86.0 m -152.27 128.95 10.81 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -148.92 133.41 17.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.643 0.259 . . . . 0.0 110.741 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 26.2 t-20 -96.26 123.1 39.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.548 178.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.5 t -110.54 106.49 20.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.005 177.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 66.35 -74.22 0.06 Allowed 'General case' 0 N--CA 1.466 0.364 0 O-C-N 123.941 0.776 . . . . 0.0 111.363 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -141.01 -0.36 1.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.683 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.2 mp -113.0 121.01 64.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.7 m -92.93 105.54 17.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.788 0.328 . . . . 0.0 110.653 179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -93.73 161.77 14.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.167 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -133.8 154.65 50.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.321 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.45 130.73 45.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.771 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.99 -5.54 84.98 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.688 179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.9 t -111.38 107.66 23.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.745 0.307 . . . . 0.0 110.638 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.541 ' HB3' ' HB ' ' A' ' 3' ' ' THR . 13.0 m -85.53 111.62 20.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.396 178.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -111.93 143.66 42.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.138 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -67.83 128.0 34.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.19 157.42 51.03 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.576 -176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.537 ' HD2' HD12 ' A' ' 31' ' ' LEU . 20.5 Cg_exo -67.31 168.82 16.79 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.27 2.647 . . . . 0.0 112.263 175.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -56.48 -48.9 76.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.804 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -58.45 -47.99 82.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.231 -178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.537 HD12 ' HD2' ' A' ' 28' ' ' PRO . 42.2 mt -69.29 -27.46 65.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.842 -175.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -57.78 -50.47 73.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.811 0.339 . . . . 0.0 110.605 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -80.24 -29.56 38.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.859 0.361 . . . . 0.0 110.558 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 65.5 t80 -63.64 -42.15 98.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.5 mt -82.83 -19.78 36.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.904 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -70.52 -23.6 62.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.67 0.747 . . . . 0.0 109.316 173.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -92.69 7.85 41.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.474 176.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -108.35 133.21 20.65 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.278 -177.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.12 -11.76 21.27 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.982 2.455 . . . . 0.0 114.832 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.431 ' CB ' ' HB2' ' A' ' 8' ' ' LYS . 6.9 p90 -118.62 23.71 11.32 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.235 -178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -129.23 119.37 23.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.94 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.614 HD12 HG21 ' A' ' 7' ' ' ILE . 14.4 mt -106.39 125.11 62.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 170.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.12 156.67 19.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.0 m -143.22 138.94 30.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.21 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 1' ' ' MET . 3.3 pm0 -110.56 117.76 34.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.216 0.532 . . . . 0.0 110.36 178.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -123.96 161.96 24.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.235 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.4 mp -81.19 159.21 24.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.963 -178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -133.68 -37.66 0.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.067 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -90.41 131.75 36.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.657 -178.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -94.59 152.17 18.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.23 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.592 ' NZ ' ' HA ' ' A' ' 54' ' ' PRO . 19.5 pttp -99.01 26.85 5.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.053 0.454 . . . . 0.0 110.388 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.0 t70 72.56 -69.15 0.2 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.477 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' A' ' 54' ' ' PRO . 9.7 t70 -121.68 123.79 27.36 Favored Pre-proline 0 C--N 1.314 -0.972 0 CA-C-O 121.014 0.435 . . . . 0.0 110.528 -177.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.592 ' HA ' ' NZ ' ' A' ' 51' ' ' LYS . 93.6 Cg_endo -99.55 32.08 0.11 Allowed 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 122.881 2.387 . . . . 0.0 114.209 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.717 HD11 ' HA ' ' A' ' 94' ' ' ILE . 6.5 tp -178.7 78.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.061 0.934 . . . . 0.0 110.79 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.541 ' OD1' HG13 ' A' ' 98' ' ' ILE . 4.9 t30 -170.15 86.39 0.12 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.801 -176.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.54 ' HB2' HD11 ' A' ' 62' ' ' LEU . 94.4 m-85 -141.39 152.01 43.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.748 0.308 . . . . 0.0 110.925 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.685 ' HB ' ' HB2' ' A' ' 61' ' ' GLU . 4.4 m -73.61 143.83 46.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.338 -178.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.545 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 7.0 pt-20 -67.36 -38.71 85.22 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.292 177.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 16.2 m -63.16 -27.58 69.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.291 0.567 . . . . 0.0 109.748 174.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.685 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 39.0 tt0 -78.77 -43.52 25.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.226 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.552 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 96.6 mt -79.26 -18.33 52.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.013 -178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -62.92 -31.42 72.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.787 0.327 . . . . 0.0 110.337 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -102.0 21.84 40.36 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.899 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 25.0 mmt -107.95 146.34 32.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 110.845 -179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.774 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 14.4 m120 -71.3 169.64 14.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 43.3 mtmt -60.41 -50.88 71.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.025 176.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.52 -29.11 67.65 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.659 0.6 . . . . 0.0 111.752 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.774 ' HG2' ' HB2' ' A' ' 66' ' ' ASN . 4.9 mm-40 -66.23 -46.38 77.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.705 0.764 . . . . 0.0 109.389 177.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.671 ' HE1' HD13 ' A' ' 91' ' ' ILE . 30.6 m-70 -63.09 -38.94 93.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.103 175.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 42.9 mt-10 -68.29 -34.61 76.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.629 -175.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.8 p -70.42 -34.6 72.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.226 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 69' ' ' GLU . 85.5 mt -58.32 -61.73 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.576 176.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.488 HD12 ' HA ' ' A' ' 81' ' ' PRO . 0.3 OUTLIER -73.6 -13.52 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -174.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.4 p -79.49 -32.87 42.53 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.366 -0.534 . . . . 0.0 109.749 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -71.14 -29.45 65.25 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.165 0.507 . . . . 0.0 109.724 173.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.6 tp -73.23 -26.58 61.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.648 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.77 -6.14 67.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.255 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.591 ' HE ' ' HA ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -73.11 -36.74 66.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.787 0.327 . . . . 0.0 110.199 -179.757 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' ARG . 45.9 m-80 72.38 137.64 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.171 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.488 ' HA ' HD12 ' A' ' 74' ' ' ILE . 6.1 Cg_endo -78.49 -4.18 13.96 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.695 2.263 . . . . 0.0 113.237 -175.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.44 -10.78 57.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.937 0.399 . . . . 0.0 111.464 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -82.72 -15.02 53.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.241 0.544 . . . . 0.0 110.504 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -119.24 146.68 45.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.754 -173.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.529 ' NZ ' ' HB3' ' A' ' 85' ' ' LYS . 5.4 ttpm? -108.76 -65.04 1.17 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.209 0.528 . . . . 0.0 110.597 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -76.52 157.48 32.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.914 -176.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.677 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -63.29 -36.78 84.8 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.18 -49.05 67.47 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.281 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.426 ' OE2' ' HB3' ' A' ' 85' ' ' LYS . 40.7 mt-10 -58.29 -37.75 75.65 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.355 0.598 . . . . 0.0 110.493 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -73.45 -34.03 65.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.613 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 87' ' ' ALA . 22.7 mm -63.4 -50.06 80.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 176.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.68 -45.17 81.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.043 -176.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' A' ' 79' ' ' ARG . 41.3 t80 -67.15 -47.61 70.52 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.457 -176.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.717 ' HA ' HD11 ' A' ' 55' ' ' ILE . 61.6 mt -67.32 -38.97 81.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.969 0.414 . . . . 0.0 110.211 -178.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.545 ' HA ' HG22 ' A' ' 98' ' ' ILE . 4.4 mm? -73.23 -16.71 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.459 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -74.35 -43.46 56.52 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 101' ' ' LYS . 2.8 mp0 -76.44 -25.81 54.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.968 -176.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.566 ' O ' ' HA3' ' A' ' 102' ' ' GLY . 14.1 tt -73.31 -14.7 16.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.529 0.68 . . . . 0.0 109.957 175.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -101.59 -49.33 4.04 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.614 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -66.67 -43.24 85.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.063 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.512 ' HE2' HG23 ' A' ' 55' ' ' ILE . 22.6 ttpp -96.38 -29.92 13.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.371 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.566 ' HA3' ' O ' ' A' ' 98' ' ' ILE . . . -74.21 -1.86 61.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.391 -175.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.13 -21.28 43.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.168 0.509 . . . . 0.0 109.922 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -80.44 93.95 6.1 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.847 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -73.18 -2.4 21.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.387 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -63.03 -31.08 72.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.264 172.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -96.33 77.64 3.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 173.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.81 95.87 9.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.91 -169.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -141.63 20.74 2.18 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.334 171.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 18.7 m170 -73.32 -57.71 3.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.973 176.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 10.8 p80 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.933 -1.032 . . . . 0.0 109.401 176.506 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttp . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -93.63 126.84 39.02 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.77 131.97 49.57 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.862 0.363 . . . . 0.0 110.823 -176.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.77 134.26 52.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.429 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -136.65 124.85 23.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.575 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.488 HD23 ' CB ' ' A' ' 19' ' ' PHE . 2.7 mm? -67.57 141.04 56.95 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.28 0.562 . . . . 0.0 111.01 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.556 HG21 HG13 ' A' ' 42' ' ' ILE . 39.1 pt -121.33 -2.4 8.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.473 174.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 95.0 mttt -144.34 149.4 36.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.294 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.39 -28.77 10.1 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.718 -0.753 . . . . 0.0 113.279 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.441 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 80.7 tttt 73.78 -37.12 0.36 Allowed 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.775 0.83 . . . . 0.0 111.504 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.9 m -151.77 123.57 8.0 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -138.88 139.93 38.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.792 0.33 . . . . 0.0 110.387 -174.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -102.9 123.42 46.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.812 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.2 t -117.85 102.06 12.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.2 mtt 63.64 -87.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.058 -179.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.17 0.2 6.51 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -105.31 125.33 60.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.8 m -95.65 117.34 30.3 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.838 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.561 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 95.8 m-85 -107.04 157.54 17.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.768 0.318 . . . . 0.0 110.914 -178.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 20' ' ' ARG . 25.9 mtt180 -124.8 156.3 38.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.835 174.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.441 ' CB ' ' HA ' ' A' ' 10' ' ' LYS . . . -71.88 127.91 34.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.817 0.341 . . . . 0.0 110.599 176.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.9 -4.04 78.1 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.234 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 56.8 t -110.99 108.54 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.778 0.323 . . . . 0.0 110.58 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.8 m -78.34 114.65 17.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.538 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.561 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 42.9 mt-30 -117.36 143.99 45.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 0.0 110.988 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.9 m -72.1 131.29 42.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.861 -175.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 m -136.99 154.98 76.46 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.55 ' HD2' HD12 ' A' ' 31' ' ' LEU . 12.9 Cg_exo -71.05 163.6 38.66 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 111.603 174.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -63.04 -26.78 69.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.465 -176.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -67.67 -36.26 80.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.715 0.293 . . . . 0.0 110.923 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.0 mt -81.1 -31.15 34.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 177.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.539 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 56.7 t80 -60.19 -40.56 90.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.565 174.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -71.16 -43.62 67.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.435 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.23 -40.98 87.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.52 -14.81 51.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.939 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -69.01 -28.8 66.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -86.04 1.76 49.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.087 175.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -121.49 94.49 48.55 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 110.475 -173.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.62 61.89 7.0 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 114.976 -168.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 1.0 OUTLIER -153.22 25.3 0.54 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.261 0.553 . . . . 0.0 110.34 166.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -123.98 139.98 53.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.389 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.556 HG13 HG21 ' A' ' 7' ' ' ILE . 11.8 mt -97.2 115.08 35.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 162.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.539 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 32.6 mt -99.75 110.14 22.54 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.218 -174.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.4 m -110.59 123.95 50.94 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.71 -175.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -90.03 114.08 25.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -101.23 144.1 30.5 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.526 -175.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 93.4 mt -118.43 147.27 43.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.898 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -98.47 86.13 3.54 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.456 0.646 . . . . 0.0 110.52 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -98.58 -40.03 8.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.584 175.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.0 154.66 0.14 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.23 176.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -158.2 131.9 7.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.292 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 65.67 91.75 0.08 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.527 0.679 . . . . 0.0 109.327 -174.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.484 ' HB2' ' HD3' ' A' ' 54' ' ' PRO . 18.6 m-20 -98.8 -56.35 0.17 Allowed Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.076 -170.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 53' ' ' ASP . 80.5 Cg_endo -74.9 41.88 0.78 Allowed 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.403 2.069 . . . . 0.0 114.246 -170.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.546 HG12 ' HG2' ' A' ' 97' ' ' GLN . 10.5 tp 179.87 29.98 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.017 0.913 . . . . 0.0 109.842 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -150.63 91.47 1.74 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.905 -173.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -142.74 153.47 43.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.672 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.585 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.6 m -62.44 143.1 57.48 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.699 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.86 -34.69 73.46 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -70.94 -28.78 64.74 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.615 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.585 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 14.2 mm-40 -71.98 -34.11 68.68 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.02 177.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.495 HD23 ' SD ' ' A' ' 65' ' ' MET . 95.8 mt -81.85 -20.4 39.01 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.253 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 32.0 mmtp -64.96 -28.13 69.31 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.076 0.465 . . . . 0.0 109.814 172.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -97.49 23.9 33.87 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.293 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.495 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -122.17 147.56 46.01 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.23 -176.37 4.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.832 0.348 . . . . 0.0 110.808 -178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 58.5 tttm -52.16 -44.14 64.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.195 -176.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.23 89.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.803 -174.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.455 ' O ' HG13 ' A' ' 73' ' ' ILE . 0.7 OUTLIER -61.84 -50.02 73.96 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.702 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.507 ' O ' HG13 ' A' ' 74' ' ' ILE . 91.2 m-70 -50.56 -46.12 57.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.186 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.476 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 43.1 mt-10 -64.67 -51.27 63.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.74 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.7 t -57.16 -50.11 73.85 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 123.301 0.376 . . . . 0.0 111.436 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.1 mt -52.84 -61.07 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.638 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.734 ' HB ' ' HD3' ' A' ' 81' ' ' PRO . 2.1 mt -77.36 -18.87 14.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.509 -170.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.0 m -69.14 -31.03 69.42 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -72.55 -32.45 66.07 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.306 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.466 HD22 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -66.39 -38.82 88.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.39 173.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.1 -69.72 0.46 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.083 -0.58 . . . . 0.0 111.816 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.453 ' O ' HG22 ' A' ' 74' ' ' ILE . 39.0 ttm180 -80.27 102.79 9.71 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 177.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.429 ' HB2' ' HD2' ' A' ' 81' ' ' PRO . 30.7 p-10 -71.22 155.42 93.07 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.178 -177.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.734 ' HD3' ' HB ' ' A' ' 74' ' ' ILE . 60.0 Cg_endo -73.67 36.76 0.4 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.105 2.537 . . . . 0.0 113.91 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.4 t -79.75 -29.86 40.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -71.56 -38.98 70.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.809 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -88.4 108.68 19.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.833 -178.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -71.81 -63.08 1.2 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.228 -172.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -72.11 150.55 43.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.937 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.44 -37.21 80.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.559 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -60.22 -39.21 85.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.907 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -62.55 -38.66 90.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.304 0.573 . . . . 0.0 110.406 178.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 34.4 mtt180 -68.76 -38.46 80.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.951 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.476 HG12 ' HE1' ' A' ' 70' ' ' HIS . 77.8 mt -65.24 -45.4 93.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.143 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.5 90.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.354 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.505 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.5 t80 -66.8 -36.77 83.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.823 -178.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.1 mt -71.92 -46.09 61.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.916 0.389 . . . . 0.0 110.365 177.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 59' ' ' GLU . 3.7 mm? -65.14 -45.55 84.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.745 -178.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -79.4 -5.4 54.55 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.369 -0.533 . . . . 0.0 110.472 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.546 ' HG2' HG12 ' A' ' 55' ' ' ILE . 6.0 tp-100 -70.94 -31.9 68.63 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 41.6 mt -65.9 -26.76 39.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.635 174.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -78.2 -41.24 35.13 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.954 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -82.26 -42.65 18.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.594 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -88.0 -13.68 41.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.029 0.443 . . . . 0.0 110.68 -174.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.51 -104.09 1.23 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.722 -0.751 . . . . 0.0 111.807 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.02 96.3 6.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.602 0.239 . . . . 0.0 110.357 177.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 39.3 tp -77.8 -72.03 0.39 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 174.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 63.49 -178.46 0.15 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.752 175.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -116.98 -14.25 10.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.766 -175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.6 t60 -79.8 80.97 6.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.778 0.323 . . . . 0.0 110.748 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -179.72 66.01 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.102 173.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -128.53 14.57 6.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.661 0.744 . . . . 0.0 109.447 176.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -177.48 -36.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.971 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.248 1.01 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.981 175.677 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -129.01 104.2 7.44 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 67.9 p -108.69 143.6 37.58 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.359 -175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.39 138.69 52.46 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.544 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -141.28 134.74 29.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.584 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.443 ' HB2' ' HA ' ' A' ' 21' ' ' ALA . 3.8 mm? -61.64 123.91 19.22 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.814 0.34 . . . . 0.0 110.646 176.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.542 HG13 ' HD2' ' A' ' 8' ' ' LYS . 13.5 pt -100.65 -23.01 4.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.014 173.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.542 ' HD2' HG13 ' A' ' 7' ' ' ILE . 2.0 mptp? -132.6 122.31 24.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.099 171.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.82 -137.44 8.68 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.218 -0.991 . . . . 0.0 112.888 177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.77 ' HG3' ' H ' ' A' ' 11' ' ' THR . 49.6 pttt -168.01 -68.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.77 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.6 p -132.14 118.38 19.53 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -129.77 111.74 12.93 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 45.3 t-20 -95.92 120.03 35.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.225 -177.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.481 HG21 HD21 ' A' ' 35' ' ' LEU . 50.5 t -119.13 104.49 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 0.0 110.682 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.2 mtt 62.95 20.14 12.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.124 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 120.11 -30.19 5.73 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.379 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.29 116.34 30.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 3.8 m -96.58 108.81 21.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.835 -177.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.406 ' HB2' ' CD2' ' A' ' 6' ' ' LEU . 37.5 m-85 -90.08 144.6 25.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.537 ' HG3' HG22 ' A' ' 11' ' ' THR . 10.1 mpt_? -117.06 149.13 40.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.561 179.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HA ' ' HB2' ' A' ' 6' ' ' LEU . . . -63.31 109.82 1.7 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.588 176.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.65 -1.78 39.27 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.193 -178.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.7 t -117.47 125.54 74.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.76 0.314 . . . . 0.0 110.516 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 m -100.04 123.49 44.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.518 178.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -118.79 150.69 39.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.71 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.6 p -92.78 126.65 37.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.213 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.9 m -124.46 157.42 65.16 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.195 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.57 ' HD2' HD12 ' A' ' 31' ' ' LEU . 38.3 Cg_exo -62.21 156.91 47.72 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.936 2.424 . . . . 0.0 110.974 171.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -68.08 -15.85 63.77 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -172.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -71.65 -43.03 66.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.423 . . . . 0.0 110.026 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.57 HD12 ' HD2' ' A' ' 28' ' ' PRO . 38.0 mt -73.74 -33.69 64.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.902 175.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.591 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 84.4 t80 -53.65 -53.95 44.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.708 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 37' ' ' GLU . 4.2 mm-40 -65.94 -36.7 84.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.581 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -62.45 -45.84 91.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 110.276 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.481 HD21 HG21 ' A' ' 14' ' ' VAL . 95.5 mt -74.08 -25.9 60.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.037 0.446 . . . . 0.0 110.602 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.02 -26.31 68.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.093 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 41.8 mt-10 -77.82 -11.29 59.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.319 175.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 35.4 m-80 -102.38 113.81 65.7 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.724 0.297 . . . . 0.0 110.93 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 19.1 Cg_exo -66.85 -7.39 18.3 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 123.184 2.589 . . . . 0.0 114.546 -173.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -101.62 17.0 23.98 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.416 -0.513 . . . . 0.0 111.917 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -119.33 131.68 55.76 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.457 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.531 ' HB ' HG21 ' A' ' 7' ' ' ILE . 14.0 tt -97.19 117.39 41.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.685 0.755 . . . . 0.0 108.998 166.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.47 ' HA ' ' O ' ' A' ' 3' ' ' THR . 4.9 mp -107.07 115.59 30.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.828 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.3 m -104.68 124.74 49.89 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.368 -176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -101.92 104.46 15.17 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.43 114.2 27.99 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.033 0.444 . . . . 0.0 110.311 178.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.27 138.62 57.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.97 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -63.33 -31.05 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -131.26 123.46 28.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.092 172.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.51 HE22 ' HA ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -116.53 166.04 12.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.267 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -102.33 12.51 36.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.784 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.51 ' HA ' HE22 ' A' ' 50' ' ' GLN . 20.7 t0 57.51 90.89 0.04 OUTLIER 'General case' 0 C--O 1.233 0.227 0 O-C-N 123.746 0.654 . . . . 0.0 110.814 -178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -66.97 113.14 11.92 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.048 -175.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.469 ' O ' HG22 ' A' ' 55' ' ' ILE . 96.1 Cg_endo -80.19 161.82 23.08 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.866 2.377 . . . . 0.0 112.387 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.702 HG12 HD22 ' A' ' 77' ' ' LEU . 7.0 tp 52.45 24.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 124.142 0.977 . . . . 0.0 111.766 178.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.536 ' OD1' HG12 ' A' ' 98' ' ' ILE . 7.9 t30 -153.1 83.51 1.2 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.128 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -136.24 152.45 50.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.113 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.736 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 24.3 m -57.23 138.27 54.9 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.375 0.422 . . . . 0.0 110.247 172.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 1.3 pt-20 -58.78 -30.43 67.55 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.712 ' H ' HG22 ' A' ' 58' ' ' THR . 15.1 m -69.2 -26.95 65.08 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.242 175.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.736 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 8.5 mm-40 -79.19 -44.49 21.78 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-O 121.061 0.458 . . . . 0.0 110.19 176.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.402 HD23 ' SD ' ' A' ' 65' ' ' MET . 57.9 mt -70.77 -20.63 62.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.455 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 59' ' ' GLU . 0.9 OUTLIER -65.12 -36.02 82.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.887 -177.195 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.08 42.16 1.96 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.719 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.402 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.6 mtt -117.53 166.37 12.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.032 0.444 . . . . 0.0 110.996 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.568 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 36.3 m-80 -83.51 162.36 20.93 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.293 174.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -67.21 -38.49 85.39 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.421 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.38 73.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.568 ' HG3' ' HB2' ' A' ' 66' ' ' ASN . 41.7 mt-10 -63.99 -49.89 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.479 ' HE1' HG12 ' A' ' 91' ' ' ILE . 34.4 m-70 -54.51 -44.46 72.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.022 173.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 42.3 mt-10 -57.81 -44.39 86.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.736 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 34.6 m -64.94 -45.56 85.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.945 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.0 mt -56.94 -59.71 2.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.347 0.594 . . . . 0.0 111.466 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 70' ' ' HIS . 5.2 mt -73.04 -21.49 19.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.036 -172.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.0 t -66.37 -36.46 82.93 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 175.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -69.51 -31.94 70.48 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.001 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.702 HD22 HG12 ' A' ' 55' ' ' ILE . 31.6 tp -63.1 -38.03 89.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.376 173.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.38 28.23 2.86 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.948 -177.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.515 ' HD2' ' OH ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -150.49 102.64 3.06 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 177.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -75.0 116.64 56.03 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.227 0.537 . . . . 0.0 110.269 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.52 ' CG ' ' HA ' ' A' ' 71' ' ' GLU . 96.0 Cg_endo -79.61 29.52 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 123.067 2.512 . . . . 0.0 112.738 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.96 -17.57 64.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.04 -27.25 30.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.666 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -82.43 109.05 16.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.733 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -71.73 -40.29 69.51 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.809 -174.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.538 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 19.2 m-80 -91.88 166.99 12.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.95 0.405 . . . . 0.0 110.148 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.527 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -85.77 -22.7 27.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.759 -178.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -63.0 -49.07 76.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.202 -177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.538 ' OE1' ' HB2' ' A' ' 86' ' ' ASN . 2.0 mp0 -58.57 -35.33 72.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.096 0.474 . . . . 0.0 110.615 177.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 94' ' ' ILE . 78.0 mtt180 -66.14 -38.61 88.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.042 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 87' ' ' ALA . 77.0 mt -66.85 -45.06 88.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.008 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.23 99.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.427 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.515 ' OH ' ' HD2' ' A' ' 79' ' ' ARG . 64.3 t80 -65.95 -36.81 84.36 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.899 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' ARG . 77.5 mt -66.88 -36.4 77.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 110.147 177.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 98' ' ' ILE . 85.4 mt -62.57 -28.07 69.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.749 174.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 93' ' ' TYR . 37.7 ttmt -63.15 -30.41 71.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.548 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.67 -31.76 57.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.478 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.536 HG12 ' OD1' ' A' ' 56' ' ' ASN . 45.0 mt -66.2 -34.66 71.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.633 0.73 . . . . 0.0 109.805 174.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -63.83 -29.47 70.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.407 177.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -86.43 -54.21 4.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.792 178.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -102.01 99.87 10.08 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.278 0.561 . . . . 0.0 110.456 -178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 147.88 -61.23 0.45 Allowed Glycine 0 N--CA 1.444 -0.793 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -162.54 91.52 0.76 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.912 0.387 . . . . 0.0 110.769 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 pp -88.71 -26.9 21.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.56 0.695 . . . . 0.0 109.524 173.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -102.73 100.01 10.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -63.46 121.21 13.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 0.0 111.541 -172.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -93.86 158.83 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 11.8 p80 -92.2 68.54 5.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.994 0.902 . . . . 0.0 109.456 173.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -115.61 -48.82 2.76 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.383 -1.28 . . . . 0.0 109.642 -176.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -90.8 -29.09 17.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.581 174.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.352 -0.833 . . . . 0.0 109.735 -179.749 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.578 ' HB3' ' HB2' ' A' ' 46' ' ' GLU . 65.6 mtt . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 121.163 0.506 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.549 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 63.8 m-85 -123.52 114.26 19.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.242 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.9 p -111.09 122.88 49.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.01 0.433 . . . . 0.0 110.954 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.21 127.64 54.02 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.351 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -121.22 118.33 29.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.834 0.35 . . . . 0.0 110.724 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -66.92 126.84 30.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.557 HD13 HG13 ' A' ' 42' ' ' ILE . 26.4 pt -116.99 -33.06 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.862 0.363 . . . . 0.0 111.959 -175.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 61.2 tttp -111.97 102.52 10.74 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -176.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.86 -119.0 1.47 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.411 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -176.5 -65.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 -173.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 m -137.78 123.21 19.55 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.7 177.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -127.64 146.82 50.42 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -175.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -119.44 117.26 27.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.606 0.241 . . . . 0.0 110.544 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 58.8 t -115.23 101.39 12.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.6 mtt 62.73 -86.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.31 178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.67 9.15 6.13 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.272 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.405 HD12 ' N ' ' A' ' 17' ' ' ILE . 4.4 mp -118.96 126.45 75.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.1 m -99.11 128.22 45.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.4 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -109.86 139.13 45.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.47 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 44.5 mtm-85 -116.49 142.43 46.88 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -56.17 117.3 3.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.98 0.419 . . . . 0.0 111.623 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.87 0.34 55.12 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.765 -0.731 . . . . 0.0 113.045 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -109.55 116.44 52.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 111.005 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.6 m -83.2 106.75 15.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.728 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -109.84 139.42 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.525 -176.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -71.99 120.27 17.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.003 0.43 . . . . 0.0 110.533 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 33.8 m -112.98 158.32 38.16 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.339 -175.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 31' ' ' LEU . 34.0 Cg_exo -62.37 150.68 86.36 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.624 2.216 . . . . 0.0 111.293 172.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -59.12 -29.99 67.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.425 -177.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.84 -44.6 85.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 0.0 110.693 176.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HA ' ' HB3' ' A' ' 34' ' ' TYR . 62.6 mt -76.07 -20.76 57.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.297 -175.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.549 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 73.8 t80 -60.8 -47.86 84.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.895 0.379 . . . . 0.0 110.06 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -73.19 -35.36 66.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.058 0.456 . . . . 0.0 110.024 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.529 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 83.3 t80 -59.92 -29.83 68.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.746 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.4 mt -94.66 -16.26 23.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.003 178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.32 -29.79 67.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.637 0.732 . . . . 0.0 109.821 177.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -90.6 7.46 39.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.253 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -115.18 106.64 50.92 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.611 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -76.58 40.67 0.8 Allowed 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.561 2.84 . . . . 0.0 115.337 -165.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.461 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 2.1 p90 -149.01 25.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 173.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.466 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 61.6 m-85 -127.06 138.61 53.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.226 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.557 HG13 HD13 ' A' ' 7' ' ' ILE . 46.8 mt -96.67 113.29 30.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.466 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 18.4 mt -100.32 107.79 19.67 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.763 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.8 p -102.87 115.06 29.86 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.652 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -90.29 135.92 33.38 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.578 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 37.3 mt-10 -101.42 108.86 20.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.205 0.526 . . . . 0.0 109.739 -175.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 75.0 mt -107.29 96.26 6.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.192 -174.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -97.24 73.53 2.48 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.76 -65.29 1.03 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.073 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -142.67 131.03 22.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.552 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.937 ' HD3' ' HB2' ' A' ' 52' ' ' ASP . 13.9 tmtt? -163.49 135.07 4.87 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.929 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.937 ' HB2' ' HD3' ' A' ' 51' ' ' LYS . 2.6 t70 78.44 136.26 0.06 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 124.176 0.922 . . . . 0.0 112.321 171.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -103.74 105.19 46.6 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 173.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.75 38.22 0.45 Allowed 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 123.403 2.735 . . . . 0.0 114.033 -171.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.662 HG12 HD13 ' A' ' 77' ' ' LEU . 10.2 tp -174.81 30.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.899 0.856 . . . . 0.0 109.314 176.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -159.0 94.72 1.23 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.996 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -138.08 157.0 47.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.839 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.915 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 1.5 m -63.77 134.09 54.65 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 173.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 13.0 pt-20 -59.42 -33.45 71.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.3 p -69.22 -30.0 68.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.24 175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.915 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 59.3 mm-40 -73.17 -37.25 66.61 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.962 -0.695 . . . . 0.0 109.635 176.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.555 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 97.6 mt -77.48 -15.34 59.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.581 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 27.4 mmtp -70.79 -37.24 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.753 0.311 . . . . 0.0 111.06 176.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.4 39.3 3.0 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.555 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 64.4 mtt -137.21 172.82 12.43 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.78 -157.51 0.63 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -68.62 -42.22 78.39 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.588 -175.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.62 62.78 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.8 mp0 -52.35 -55.88 18.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.971 0.415 . . . . 0.0 110.392 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.608 ' HE1' HG12 ' A' ' 91' ' ' ILE . 28.0 m-70 -58.96 -44.6 91.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.831 -178.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 63.5 mt-10 -63.63 -41.46 98.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.772 -0.195 . . . . 0.0 111.108 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.1 p -65.34 -34.62 78.75 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.521 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.536 HD12 ' HA ' ' A' ' 70' ' ' HIS . 96.6 mt -58.81 -57.59 10.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.962 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 70' ' ' HIS . 1.3 mt -72.55 -16.1 17.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.862 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 66.7 m -67.9 -36.51 80.33 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -66.44 -34.52 78.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.007 173.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.662 HD13 HG12 ' A' ' 55' ' ' ILE . 46.3 tp -63.59 -38.37 90.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.008 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 104.06 23.8 7.96 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.083 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.468 ' HG3' ' OH ' ' A' ' 93' ' ' TYR . 0.1 OUTLIER -131.66 126.23 34.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.727 0.298 . . . . 0.0 110.269 -178.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -73.89 136.51 76.77 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.888 178.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.481 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 5.0 Cg_exo -80.23 49.46 3.21 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.082 2.521 . . . . 0.0 111.329 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -49.75 -54.29 19.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.153 -170.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -106.27 24.73 12.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.338 0.589 . . . . 0.0 110.964 -174.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -107.61 120.27 41.76 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.466 ' HG2' ' OE1' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -115.56 -32.86 5.41 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.918 -175.02 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.58 169.59 10.22 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.548 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -72.98 -41.26 64.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.671 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.19 -44.8 88.23 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.632 0.582 . . . . 0.0 111.628 -177.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' A' ' 85' ' ' LYS . 33.3 mt-10 -58.09 -38.78 77.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 110.55 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.553 ' HD3' ' HB2' ' A' ' 70' ' ' HIS . 73.0 mtt85 -72.81 -32.04 65.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.711 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.608 HG12 ' HE1' ' A' ' 70' ' ' HIS . 75.8 mt -67.49 -47.15 81.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.15 -44.77 75.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.189 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.468 ' OH ' ' HG3' ' A' ' 79' ' ' ARG . 37.0 t80 -65.05 -40.51 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.92 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.489 ' O ' HG13 ' A' ' 98' ' ' ILE . 86.9 mt -67.52 -44.31 86.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.425 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.487 HD13 HD12 ' A' ' 98' ' ' ILE . 3.7 mm? -62.61 -41.37 98.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.292 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -65.32 -28.0 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 110.991 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -19.4 46.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.915 0.388 . . . . 0.0 110.39 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 94' ' ' ILE . 75.9 mt -74.27 -42.2 50.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 172.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -65.8 -48.74 70.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.28 176.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -89.77 32.45 0.89 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.798 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -66.53 -34.91 78.97 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 177.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 97.26 -107.6 3.52 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.193 172.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 68.03 84.02 0.16 Allowed 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.505 0.722 . . . . 0.0 112.201 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -111.3 122.89 49.03 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 169.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.14 120.36 23.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.648 0.737 . . . . 0.0 111.349 -176.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -90.98 16.8 8.84 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.364 -177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -87.84 -26.41 22.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.595 -173.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 25.7 p-80 -82.56 114.26 20.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.375 0.607 . . . . 0.0 110.378 -178.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -90.38 -16.44 29.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.899 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -87.92 138.04 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.295 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.8 p80 . . . . . 0 C--O 1.244 0.764 0 CA-C-O 118.412 -0.804 . . . . 0.0 109.421 175.659 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.303 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -95.87 108.09 20.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 44' ' ' THR . 0.2 OUTLIER -116.28 134.86 54.44 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -170.037 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.65 118.66 28.66 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 174.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 38.9 ttpt -119.11 126.4 51.54 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.835 0.35 . . . . 0.0 110.332 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.645 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -66.02 125.33 25.12 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.401 HG13 ' HG3' ' A' ' 8' ' ' LYS . 29.3 pt -111.9 -30.91 2.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.267 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.401 ' HG3' HG13 ' A' ' 7' ' ' ILE . 64.2 mttp -127.89 111.53 13.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.781 0.324 . . . . 0.0 110.726 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.47 -13.29 3.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.658 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 61.5 mttp 71.39 -51.02 0.69 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 123.496 0.719 . . . . 0.0 111.922 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.8 m -150.35 129.45 12.69 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.741 0.305 . . . . 0.0 110.349 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -156.77 129.71 7.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 10.5 p30 -111.19 146.15 37.4 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.913 -177.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 HD21 ' A' ' 35' ' ' LEU . 44.6 t -127.93 99.25 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.274 178.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 61.9 mtm 57.74 49.55 12.1 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.855 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.49 -35.58 4.52 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.603 176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.491 HD13 HD11 ' A' ' 31' ' ' LEU . 4.0 mp -80.24 108.76 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 29.2 m -91.44 126.77 36.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.017 -178.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 71.7 m-85 -108.03 146.04 33.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.81 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.9 mtt180 -133.87 154.88 50.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.688 0.28 . . . . 0.0 110.972 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.645 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -60.76 105.34 0.44 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.081 178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.74 11.17 47.89 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.688 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.3 t -116.67 108.21 24.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.887 0.375 . . . . 0.0 110.632 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.414 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 15.2 m -74.95 122.13 22.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.592 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -121.51 129.13 52.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.504 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.5 p -74.42 129.91 38.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.732 0.301 . . . . 0.0 110.351 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 29.5 m -120.73 153.4 56.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.468 -174.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.542 ' HD2' HD12 ' A' ' 31' ' ' LEU . 19.5 Cg_exo -67.12 164.99 28.03 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.714 2.276 . . . . 0.0 111.167 171.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -61.41 -29.99 70.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.858 0.361 . . . . 0.0 110.938 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -64.72 -50.16 68.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.713 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.542 HD12 ' HD2' ' A' ' 28' ' ' PRO . 45.2 mt -71.72 -29.41 64.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.503 -175.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -55.44 -51.36 67.18 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.523 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 44.8 mt-10 -75.42 -31.25 60.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.98 0.419 . . . . 0.0 110.776 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -61.46 -33.36 73.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.303 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.536 HD22 ' CE1' ' A' ' 41' ' ' PHE . 93.2 mt -98.69 -12.61 20.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.982 177.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.559 ' HA ' HD11 ' A' ' 43' ' ' LEU . 5.8 t30 -61.22 -36.16 79.16 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.565 0.698 . . . . 0.0 109.882 173.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 37' ' ' GLU . 7.9 pt-20 -87.12 13.41 9.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.266 176.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.422 HD22 ' C ' ' A' ' 37' ' ' GLU . 0.9 OUTLIER -116.58 122.96 31.07 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-O 120.792 0.329 . . . . 0.0 110.352 177.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 96.3 Cg_endo -88.64 22.42 0.86 Allowed 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.992 2.461 . . . . 0.0 114.101 -174.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -127.58 21.49 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.188 0.518 . . . . 0.0 111.669 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CE1' HD22 ' A' ' 35' ' ' LEU . 73.9 m-85 -128.49 145.49 51.09 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.492 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.9 tt -97.33 124.32 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 171.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 36' ' ' ASN . 12.5 mt -100.84 108.37 20.15 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.141 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.623 ' HB ' ' HB ' ' A' ' 3' ' ' THR . 20.8 m -101.11 106.84 18.14 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.818 -174.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -107.97 110.32 22.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.224 -176.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -101.64 104.87 15.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.825 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 56.3 tp -120.01 95.89 4.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.965 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.06 92.3 3.67 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.3 0.571 . . . . 0.0 110.181 177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -85.1 93.83 8.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.208 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -113.94 -6.84 13.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.95 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -128.73 94.53 3.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.19 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -141.99 1.73 1.48 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -89.69 126.85 56.5 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.347 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.442 ' O ' HG22 ' A' ' 55' ' ' ILE . 20.0 Cg_exo -66.58 -177.1 0.82 Allowed 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.858 2.372 . . . . 0.0 111.754 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.786 HG12 HD22 ' A' ' 77' ' ' LEU . 10.8 tp 49.02 25.61 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 CA-C-O 121.915 0.864 . . . . 0.0 111.458 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -141.62 96.46 2.98 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.819 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.453 ' HB2' HD11 ' A' ' 62' ' ' LEU . 83.8 m-85 -140.6 161.91 36.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.709 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.644 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 1.1 m -61.88 133.58 55.61 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 60' ' ' SER . 0.6 OUTLIER -66.5 -32.95 74.63 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 119.969 -0.693 . . . . 0.0 109.706 -179.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.492 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 10.8 m -69.73 -24.83 63.61 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.223 0.535 . . . . 0.0 109.819 174.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.644 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 59.4 tt0 -81.66 -35.52 29.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.849 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 57' ' ' TYR . 96.3 mt -83.06 -6.32 59.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.718 175.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD2' HD13 ' A' ' 91' ' ' ILE . 15.5 tptt -66.25 -27.1 67.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.626 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.21 -119.01 4.3 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 173.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.459 ' HB3' ' H ' ' A' ' 66' ' ' ASN . 24.2 mmt 59.74 -158.17 0.32 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.423 0.63 . . . . 0.0 111.927 174.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.762 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 42.9 t-20 -123.64 158.66 31.03 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.96 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -67.27 -36.36 81.4 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 174.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 71' ' ' GLU . . . -61.85 -32.77 73.14 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.131 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.762 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 12.5 mm-40 -62.66 -56.67 15.62 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.671 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.8 m80 -51.45 -40.61 59.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.963 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 45.1 mm-40 -51.84 -64.99 0.64 Allowed 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.302 0.376 . . . . 0.0 110.549 175.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.8 m -56.91 -44.47 82.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.216 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.2 mt -53.28 -57.22 5.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.648 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.671 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.2 mt -82.05 -20.96 10.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.753 -172.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.51 -33.38 74.02 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -73.38 -27.76 61.65 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.786 HD22 HG12 ' A' ' 55' ' ' ILE . 56.7 tp -65.89 -29.75 70.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.97 0.414 . . . . 0.0 110.173 172.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.84 9.38 26.56 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.466 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -133.47 97.82 4.05 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.461 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 14.5 m120 -68.42 131.8 91.59 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.698 -176.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 80' ' ' ASN . 57.1 Cg_endo -88.92 65.39 2.75 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.924 2.416 . . . . 0.0 112.379 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.1 t -86.36 -31.7 21.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.471 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -90.05 -25.01 21.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.937 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -82.32 108.65 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -92.69 -61.92 1.5 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.52 -168.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -72.81 163.72 27.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.04 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -63.64 -45.73 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.52 -174.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.526 ' HA ' HD12 ' A' ' 91' ' ' ILE . 10.3 t70 -65.97 -32.27 73.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.077 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.37 -44.0 96.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.544 0.688 . . . . 0.0 110.074 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -68.57 -34.83 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.24 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 88' ' ' ASP . 86.3 mt -65.8 -41.51 90.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.12 176.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.16 -47.34 83.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.71 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -63.33 -44.76 93.97 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.623 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.485 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.0 mt -61.33 -45.56 98.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.206 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -47.95 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.562 -177.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.0 mttp -67.13 -20.87 65.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.476 HE21 ' HB3' ' A' ' 97' ' ' GLN . 0.9 OUTLIER -80.16 -40.49 27.2 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 94' ' ' ILE . 83.4 mt -63.74 -35.32 72.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.456 177.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -60.15 -33.64 72.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.199 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -64.44 -34.29 77.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.32 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -91.57 18.88 6.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.357 178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.1 -45.79 47.77 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.23 -0.51 . . . . 0.0 112.751 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -113.89 141.48 47.3 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.2 mt 53.17 64.09 1.99 Allowed 'General case' 0 C--O 1.235 0.333 0 O-C-N 123.7 0.625 . . . . 0.0 110.473 -176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 1.0 OUTLIER -80.34 28.54 0.31 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.21 -176.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.4 p80 41.88 88.82 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.136 0.974 . . . . 0.0 113.028 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -64.22 -26.59 68.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.042 177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -120.21 105.16 10.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.727 174.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -83.79 4.37 29.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.568 -177.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.9 t-160 71.78 100.22 0.07 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.182 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.6 t60 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.632 -177.625 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.8 mtp . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -103.57 129.41 50.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.641 ' OG1' ' HB ' ' A' ' 44' ' ' THR . 73.9 p -131.59 155.48 47.44 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.686 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.483 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -126.84 137.8 53.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.224 177.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HB2' ' OG ' ' A' ' 24' ' ' SER . 5.8 ttpm? -120.73 116.97 26.28 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.921 0.391 . . . . 0.0 111.104 -177.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.602 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -67.99 124.28 22.95 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.582 HG13 ' N ' ' A' ' 8' ' ' LYS . 18.9 pt -117.61 -36.67 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.909 0.385 . . . . 0.0 111.695 -177.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.582 ' N ' HG13 ' A' ' 7' ' ' ILE . 44.9 tttm -92.06 30.56 1.4 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.747 -167.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.1 -126.7 0.85 Allowed Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.62 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -160.13 -44.45 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 57.7 m -152.99 125.01 7.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.989 174.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -140.01 117.55 11.49 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.2 t-20 -91.22 115.87 28.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.3 t -106.38 97.29 5.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.726 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 62.8 mtt 59.39 22.65 11.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.931 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 121.6 -33.75 4.18 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.578 -177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.9 mm -78.32 108.79 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 12.3 m -91.06 101.22 13.97 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.702 0.286 . . . . 0.0 110.759 -175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' HA ' ' OE1' ' A' ' 25' ' ' GLN . 98.4 m-85 -86.06 144.37 27.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.587 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -124.97 143.26 50.98 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -51.71 118.27 3.26 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.67 4.03 59.33 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.768 -0.651 . . . . 0.0 113.224 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.5 t -117.75 112.1 37.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 117.024 0.412 . . . . 0.0 111.523 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 71.5 m -74.45 116.47 15.16 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.896 171.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.5 ' OE1' ' HA ' ' A' ' 19' ' ' PHE . 25.6 mt-30 -116.3 146.78 42.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.498 -178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.533 ' HA ' HG22 ' A' ' 3' ' ' THR . 13.0 p -67.51 131.81 46.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.127 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 35.6 m -134.7 144.83 52.35 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.922 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.557 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.7 Cg_exo -66.96 161.77 41.0 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.627 2.218 . . . . 0.0 110.883 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -59.02 -31.53 68.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.613 0.245 . . . . 0.0 111.469 -176.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.51 -48.49 79.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.862 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.557 HD12 ' HD2' ' A' ' 28' ' ' PRO . 68.9 mt -73.4 -29.01 62.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.667 0.27 . . . . 0.0 110.537 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -55.6 -48.95 74.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.962 174.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -71.56 -34.87 70.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.309 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 66.8 t80 -64.94 -40.84 95.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.595 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.498 HD22 ' CE1' ' A' ' 41' ' ' PHE . 73.6 mt -81.93 -20.13 39.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.741 0.305 . . . . 0.0 110.629 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -66.32 -26.05 67.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.679 0.752 . . . . 0.0 109.051 169.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB3' ' O ' ' A' ' 34' ' ' TYR . 13.7 tp10 -79.4 -15.42 57.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.929 176.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 40' ' ' TYR . 40.4 m-80 -115.14 113.18 43.85 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.532 -174.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 2.8 Cg_exo -75.32 41.34 0.76 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.016 2.477 . . . . 0.0 114.105 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 38' ' ' ASN . 9.1 m-85 -111.75 -6.26 14.34 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.926 0.393 . . . . 0.0 110.001 176.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.498 ' CE1' HD22 ' A' ' 35' ' ' LEU . 78.7 m-85 -124.41 141.79 51.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.783 -169.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.553 HG13 HD13 ' A' ' 7' ' ' ILE . 68.9 mt -110.57 111.25 35.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 164.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 6.3 mp -82.91 148.52 27.63 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 120.955 0.407 . . . . 0.0 111.193 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.641 ' HB ' ' OG1' ' A' ' 3' ' ' THR . 17.7 m -116.53 107.33 14.62 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.675 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -94.38 112.61 24.4 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -104.81 115.64 30.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.151 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.3 tt -91.12 114.03 26.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -79.48 102.22 8.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.372 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -76.54 110.26 10.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.077 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -112.19 79.56 1.23 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -102.87 -11.79 18.01 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.172 0.511 . . . . 0.0 110.167 -175.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -73.23 117.69 15.28 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.757 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 56.37 84.26 0.21 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.409 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.487 ' HB2' ' HA ' ' A' ' 73' ' ' ILE . 2.7 Cg_exo -76.74 96.36 1.09 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.362 2.708 . . . . 0.0 112.606 -178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.459 HG12 HD13 ' A' ' 77' ' ' LEU . 10.4 tp -171.33 21.2 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 122.46 1.124 . . . . 0.0 108.998 174.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -153.29 100.17 2.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.901 -175.071 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.425 ' HB2' HD11 ' A' ' 62' ' ' LEU . 90.9 m-85 -142.66 177.83 8.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.316 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.642 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -76.76 133.37 39.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.928 177.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 63' ' ' LYS . 4.2 pt-20 -66.97 -33.01 74.65 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.46 -178.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 59' ' ' GLU . 11.5 p -74.28 -22.71 59.17 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.642 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 53.9 tt0 -80.19 -40.58 26.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.452 176.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' O ' ' HE1' ' A' ' 70' ' ' HIS . 81.0 mt -75.85 -9.98 59.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.746 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' A' ' 59' ' ' GLU . 7.6 tppt? -66.39 -19.84 65.91 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.13 -113.23 2.11 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.52 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 47.7 mtt 62.13 -175.4 0.14 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.53 0.681 . . . . 0.0 111.562 -177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.682 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 46.4 t30 -95.49 151.41 19.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.279 174.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 51.8 mtmt -54.1 -48.24 70.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.805 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.4 -30.39 64.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.088 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.682 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 7.0 mm-40 -63.67 -52.02 62.53 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 73' ' ' ILE . 77.7 m-70 -55.79 -44.21 77.57 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 67' ' ' LYS . 4.3 mm-40 -63.49 -43.45 97.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.611 -177.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -64.19 -40.61 96.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.757 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.4 mt -51.99 -62.15 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.13 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 70' ' ' HIS . 0.4 OUTLIER -76.45 -16.93 15.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.935 -174.035 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.0 t -66.34 -35.2 79.74 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -75.34 -32.02 60.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.353 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.459 HD13 HG12 ' A' ' 55' ' ' ILE . 47.1 tp -63.51 -36.21 83.03 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.151 0.5 . . . . 0.0 110.404 174.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.9 5.3 33.41 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.112 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.13 119.5 39.48 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -63.07 122.57 75.99 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.053 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.72 -3.33 11.76 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.189 2.592 . . . . 0.0 111.926 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.0 m -68.34 -12.2 60.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.965 177.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.97 -34.37 71.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.188 0.518 . . . . 0.0 110.559 175.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.628 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . 57.8 m-85 -100.23 122.75 43.53 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.95 -171.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -82.33 -40.19 21.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.304 -178.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.87 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 94.6 m-20 -96.38 162.16 13.61 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.047 0.451 . . . . 0.0 111.597 -176.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.453 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -70.62 -36.08 73.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.54 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -63.92 -36.86 85.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.428 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.87 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 21.1 mm-40 -59.45 -40.37 86.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.368 0.604 . . . . 0.0 109.75 176.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 94' ' ' ILE . 71.9 mtt85 -63.81 -49.14 74.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.619 177.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 87' ' ' ALA . 61.8 mt -60.08 -42.85 91.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.171 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.19 77.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.379 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -78.05 -41.15 36.42 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.519 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.551 ' O ' HG13 ' A' ' 98' ' ' ILE . 70.1 mt -62.49 -44.67 99.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.55 ' HA ' HD12 ' A' ' 98' ' ' ILE . 14.9 mt -62.23 -29.23 70.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.625 176.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.471 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 3.9 ttmp? -61.84 -42.37 98.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.775 -177.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -81.1 -20.12 42.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 94' ' ' ILE . 96.6 mt -71.75 -44.27 68.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.127 0.489 . . . . 0.0 110.09 176.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -79.86 -46.11 17.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.372 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -109.3 91.92 3.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.133 0.492 . . . . 0.0 110.025 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.427 ' HB2' ' H ' ' A' ' 102' ' ' GLY . 11.0 pttm -103.5 -156.66 0.57 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.885 -177.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 101' ' ' LYS . . . -63.97 91.42 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 116.096 -0.502 . . . . 0.0 113.089 -176.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -86.74 -40.32 15.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.5 tt -95.06 96.18 9.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.046 176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.36 149.65 22.2 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.712 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -95.22 54.77 1.68 Allowed 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 -176.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 9.6 m80 69.98 120.93 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.257 -175.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -73.2 132.35 43.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.693 -175.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 3.5 p-80 -148.68 114.33 5.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.246 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 71.6 -44.66 0.6 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.686 0.794 . . . . 0.0 111.129 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.1 p80 . . . . . 0 C--O 1.245 0.853 0 CA-C-O 118.292 -0.861 . . . . 0.0 109.693 174.498 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mmt . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 120.619 0.247 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.472 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 70.3 m-85 -81.68 142.71 32.45 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.877 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -131.69 135.47 46.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.026 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.17 122.51 47.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.183 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.531 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 88.6 tttt -109.01 107.23 17.51 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.421 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.633 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.3 tm? -65.84 122.3 17.01 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.545 HD13 HG13 ' A' ' 42' ' ' ILE . 43.2 pt -113.78 -24.14 3.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -178.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -102.59 105.16 15.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.984 -176.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 116.58 -129.84 8.65 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.474 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 97.9 mttt -154.68 -46.18 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.9 p -136.21 153.82 51.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.645 172.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -162.41 116.45 1.79 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.757 0.313 . . . . 0.0 110.159 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 49.6 t-20 -90.76 112.31 24.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -178.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.502 HG11 HD21 ' A' ' 35' ' ' LEU . 54.9 t -104.2 108.69 25.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.793 177.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 65.41 -75.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.795 0.684 . . . . 0.0 111.364 -178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.85 6.19 1.81 Allowed Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.607 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.2 mp -115.84 119.39 61.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 22.2 m -92.83 105.7 17.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.972 0.415 . . . . 0.0 110.585 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -84.64 161.82 19.97 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.414 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 62.6 mtt180 -133.66 136.99 45.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.446 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.633 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.29 109.49 0.55 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 111.817 179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.17 -7.55 30.85 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.516 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.6 t -111.21 127.2 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -179.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 12.1 p -102.95 104.21 14.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.42 177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -102.02 149.83 23.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.778 0.323 . . . . 0.0 110.819 -178.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -73.52 132.74 43.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.814 -178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.8 m -126.9 155.35 75.69 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.328 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.527 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -64.26 151.93 83.39 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.692 2.261 . . . . 0.0 110.962 172.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' H ' ' HG3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -64.75 -20.78 66.54 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.4 mtmt -68.5 -45.86 71.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.354 0.597 . . . . 0.0 110.228 174.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.527 HD12 ' HD2' ' A' ' 28' ' ' PRO . 77.7 mt -75.18 -26.22 58.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.499 -179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.472 ' CD1' ' HB3' ' A' ' 2' ' ' PHE . 84.9 t80 -57.32 -50.76 71.93 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.327 177.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 8.0 mm-40 -70.86 -33.43 70.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.131 179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -62.31 -46.14 90.07 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 110.656 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.516 HD22 ' CE1' ' A' ' 41' ' ' PHE . 81.9 mt -79.24 -19.46 50.59 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.058 0.456 . . . . 0.0 110.344 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.438 ' HB3' ' HA ' ' A' ' 33' ' ' GLU . 32.7 t30 -62.97 -31.87 73.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.798 174.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.48 -1.12 55.22 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.877 176.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -123.48 117.72 27.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.117 0.484 . . . . 0.0 111.682 -174.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -76.57 39.47 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.416 0 C-N-CA 123.293 2.662 . . . . 0.0 113.851 -175.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.446 ' HB2' ' CD1' ' A' ' 41' ' ' PHE . 72.4 m-85 -98.38 -18.44 18.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.066 0.46 . . . . 0.0 110.208 176.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.516 ' CE1' HD22 ' A' ' 35' ' ' LEU . 68.3 m-85 -127.35 147.24 50.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.778 -169.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.545 HG13 HD13 ' A' ' 7' ' ' ILE . 60.0 mt -97.71 103.72 15.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 162.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.44 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.3 mp -87.06 131.24 34.18 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.608 -174.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.2 m -118.69 127.89 54.0 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.613 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -90.14 106.79 18.72 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.365 0.602 . . . . 0.0 109.417 175.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 49' ' ' ASN . 9.0 mm-40 -102.06 124.06 47.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.074 -174.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -95.44 109.48 21.66 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.251 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.6 t30 63.33 79.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.927 0.767 . . . . 0.0 110.386 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.595 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 25.2 p-10 -112.36 29.44 7.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.595 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -60.58 105.72 0.47 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.081 -178.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.753 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 0.5 OUTLIER -108.03 110.46 22.17 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.482 177.682 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -59.4 140.54 56.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.486 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -114.99 106.38 51.67 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.321 177.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -69.86 88.64 0.54 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.874 2.382 . . . . 0.0 111.154 177.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.683 HG21 HD13 ' A' ' 77' ' ' LEU . 11.2 tp -174.89 31.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 122.418 1.104 . . . . 0.0 108.397 -178.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -149.57 96.57 2.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.91 -173.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -142.72 165.67 26.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.537 -176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.403 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 21.6 m -64.9 129.81 41.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.353 175.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 1.4 pm0 -61.77 -38.59 88.59 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 179.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.8 m -62.26 -30.97 71.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 36.5 tt0 -78.44 -35.0 47.46 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.348 0.594 . . . . 0.0 109.83 178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.7 mt -77.64 -14.8 59.53 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.97 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 70.8 mmtt -66.06 -27.73 68.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 65' ' ' MET . . . -97.72 -148.52 23.96 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 169.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.473 ' HG3' ' OE1' ' A' ' 69' ' ' GLU . 43.6 ttm 68.75 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.106 0.479 . . . . 0.0 111.128 175.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -73.5 163.28 28.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.225 0.536 . . . . 0.0 111.153 -174.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -56.83 -41.41 77.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.156 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.36 90.87 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.221 0.326 . . . . 0.0 111.38 -174.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.473 ' OE1' ' HG3' ' A' ' 65' ' ' MET . 47.7 mt-10 -60.1 -56.31 23.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.429 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.635 ' O ' HG13 ' A' ' 74' ' ' ILE . 78.7 m-70 -51.11 -42.22 60.52 Favored 'General case' 0 C--O 1.226 -0.135 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.212 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 38.7 mt-10 -68.59 -41.52 79.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.748 -177.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 27.2 t -63.34 -41.64 98.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 69' ' ' GLU . 76.0 mt -52.95 -58.86 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.403 176.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.635 HG13 ' O ' ' A' ' 70' ' ' HIS . 7.2 mt -72.28 -24.25 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.528 -173.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.53 ' HA ' ' O ' ' A' ' 79' ' ' ARG . 49.9 m -74.94 -33.12 61.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.987 0.423 . . . . 0.0 110.008 175.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.1 -31.05 71.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.228 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.683 HD13 HG21 ' A' ' 55' ' ' ILE . 35.4 tp -61.62 -29.44 70.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.002 174.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 118.72 -7.07 13.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.934 -0.651 . . . . 0.0 111.507 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.53 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 mmt180 -90.49 -172.78 3.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.699 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 3.9 t-20 -150.8 109.29 3.09 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.68 178.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.54 ' HG2' ' HA ' ' A' ' 71' ' ' GLU . 5.2 Cg_exo -77.79 54.0 4.63 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 123.218 2.612 . . . . 0.0 112.896 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.0 p -83.61 -37.32 23.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.22 0.533 . . . . 0.0 110.568 177.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -93.94 7.32 45.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.447 0.641 . . . . 0.0 110.48 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -105.5 108.53 20.1 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 175.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -97.42 -45.05 6.6 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -171.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.541 ' HB2' ' HG3' ' A' ' 89' ' ' GLU . 39.2 m-80 -80.53 168.01 19.43 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.234 0.54 . . . . 0.0 111.541 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 90' ' ' ARG . . . -81.05 -36.92 29.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.507 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.539 ' HA ' HD12 ' A' ' 91' ' ' ILE . 18.5 t70 -70.94 -32.77 69.75 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.863 -178.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.541 ' HG3' ' HB2' ' A' ' 86' ' ' ASN . 50.8 mt-10 -59.5 -46.33 89.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 110.748 177.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 87' ' ' ALA . 18.2 ptp180 -71.3 -27.55 63.49 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.528 -178.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 88' ' ' ASP . 96.6 mt -65.43 -45.95 91.49 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.89 -42.81 80.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.769 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.418 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 42.3 t80 -68.22 -39.15 82.43 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.793 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 55' ' ' ILE . 70.5 mt -66.04 -37.97 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.899 0.381 . . . . 0.0 110.283 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 98' ' ' ILE . 13.3 mt -65.29 -37.5 87.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.402 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.9 tmtm? -59.06 -31.15 68.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.939 -177.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.616 ' HG3' ' CG1' ' A' ' 55' ' ' ILE . 7.5 mm-40 -74.27 -30.94 62.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.487 -178.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.507 HD12 HD23 ' A' ' 95' ' ' LEU . 56.0 mt -67.65 -28.16 40.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.373 177.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -69.05 -18.6 64.03 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.96 0.409 . . . . 0.0 110.538 176.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -81.64 0.32 39.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.524 179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -97.24 138.78 34.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.307 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -95.94 -117.19 3.23 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.696 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -111.97 148.75 33.11 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 -175.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.6 128.65 34.71 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 167.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -62.03 112.4 2.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.051 0.453 . . . . 0.0 111.443 -171.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.38 -23.87 17.6 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 1.2 t60 56.36 41.07 29.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.934 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -80.57 124.84 29.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.657 -170.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 110' ' ' HIS . 18.9 t-80 -146.1 -71.44 0.25 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.597 172.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.44 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 47.8 t60 174.58 131.92 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 123.71 0.632 . . . . 0.0 110.215 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.0 p80 . . . . . 0 C--O 1.243 0.76 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 172.955 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.869 ' HB3' ' HB2' ' A' ' 46' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.535 ' O ' ' HA ' ' A' ' 26' ' ' THR . 90.0 m-85 -117.18 110.35 18.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.189 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 24' ' ' SER . 0.2 OUTLIER -106.79 131.7 53.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.789 -177.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -125.47 137.28 53.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.172 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -139.59 137.91 35.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.757 0.313 . . . . 0.0 111.08 -179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -65.11 118.58 9.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.653 174.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.591 HG21 ' HB ' ' A' ' 42' ' ' ILE . 36.3 pt -100.26 -6.34 9.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.502 0.667 . . . . 0.0 109.796 175.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.6 tttp -140.19 130.79 25.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.483 179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 109.12 -132.82 11.29 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.315 -0.945 . . . . 0.0 112.42 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -164.32 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.618 0.247 . . . . 0.0 110.364 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.514 HG22 ' HG2' ' A' ' 20' ' ' ARG . 12.4 p -145.16 134.99 23.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.238 179.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -147.18 128.07 14.44 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -97.5 107.86 20.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.793 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 35' ' ' LEU . 61.6 t -96.55 95.16 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.1 mtt 65.7 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.099 -178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -133.56 -1.87 3.73 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.101 -0.571 . . . . 0.0 111.938 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.4 mp -102.06 113.81 39.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.5 m -87.99 116.55 26.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.733 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -98.59 151.09 21.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.735 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HG2' HG22 ' A' ' 11' ' ' THR . 15.5 mtp180 -132.32 137.84 47.58 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 109.9 1.02 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.028 0.442 . . . . 0.0 111.037 177.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 111.2 -3.32 28.32 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.308 -178.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -118.81 113.84 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.831 0.348 . . . . 0.0 111.026 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.433 ' HB3' HG22 ' A' ' 3' ' ' THR . 33.6 m -85.09 126.05 33.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.262 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -129.17 151.48 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.37 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.535 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 1.2 p -80.92 138.59 36.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.855 0.359 . . . . 0.0 111.806 -176.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.9 153.4 81.7 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.959 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 7.6 Cg_exo -74.29 171.39 18.14 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 123.05 2.5 . . . . 0.0 112.264 175.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -51.9 -46.76 64.71 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.968 -178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.19 -45.34 94.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.411 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' A' ' 28' ' ' PRO . 62.8 mt -73.12 -28.93 62.55 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -58.44 -47.01 85.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -68.11 -41.29 81.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.575 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.98 -45.56 92.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.845 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 14' ' ' VAL . 87.2 mt -76.83 -23.44 52.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.84 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.69 -29.59 70.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.362 0.601 . . . . 0.0 109.705 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -78.07 -6.69 55.41 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 38.1 m-80 -118.87 101.5 50.23 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.873 0.368 . . . . 0.0 110.61 -177.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 38' ' ' ASN . 14.2 Cg_exo -69.42 11.66 0.35 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.523 2.816 . . . . 0.0 114.735 -171.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.552 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 17.7 p90 -105.18 10.57 33.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.258 0.552 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.443 ' CE2' HD22 ' A' ' 35' ' ' LEU . 45.1 m-85 -117.07 136.29 53.09 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.885 172.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.591 ' HB ' HG21 ' A' ' 7' ' ' ILE . 9.9 tt -97.25 133.5 38.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 167.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mp -120.79 141.56 50.4 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.162 0.506 . . . . 0.0 110.554 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.8 m -130.15 116.45 18.47 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.586 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -99.2 113.47 25.75 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.513 0.673 . . . . 0.0 110.327 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.869 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 81.7 mt-10 -101.93 109.17 20.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.987 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.6 mp -94.95 96.33 9.22 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 176.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -127.53 17.94 6.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.617 0.722 . . . . 0.0 109.598 -175.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -149.89 159.17 44.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.138 -177.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -81.41 149.33 28.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.979 0.418 . . . . 0.0 110.805 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -119.49 138.62 53.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.189 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.5 t70 51.91 87.91 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.598 0.561 . . . . 0.0 111.057 174.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.481 ' OD2' HG22 ' A' ' 55' ' ' ILE . 20.1 t70 -52.62 116.3 8.62 Favored Pre-proline 0 N--CA 1.469 0.509 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.183 -170.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.45 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 74.4 Cg_endo -95.11 89.02 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.299 2.666 . . . . 0.0 113.633 -177.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.531 HG12 HD13 ' A' ' 77' ' ' LEU . 9.3 tp 179.66 26.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.968 0.89 . . . . 0.0 109.666 174.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.466 ' HB2' HG12 ' A' ' 98' ' ' ILE . 6.5 p30 -161.88 105.3 1.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.793 -175.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.522 ' HB2' ' HG ' ' A' ' 62' ' ' LEU . 68.5 m-85 -142.89 161.65 37.54 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.039 -177.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.488 HG22 ' H ' ' A' ' 60' ' ' SER . 13.9 m -60.43 142.97 54.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.612 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 2.5 pp20? -60.01 -36.95 78.32 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.488 ' H ' HG22 ' A' ' 58' ' ' THR . 6.5 m -67.53 -29.19 68.53 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.187 176.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HB2' ' HB ' ' A' ' 58' ' ' THR . 33.5 tt0 -77.24 -34.51 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.88 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.522 ' HG ' ' HB2' ' A' ' 57' ' ' TYR . 87.5 mt -77.18 -21.24 54.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.11 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 29.4 mmtp -62.12 -40.24 95.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.906 172.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -92.82 47.68 2.5 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.155 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.482 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.9 mtt -141.03 136.52 32.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.464 ' ND2' ' HG2' ' A' ' 69' ' ' GLU . 11.2 p30 -71.17 173.2 7.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.015 0.436 . . . . 0.0 110.728 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.37 -41.21 94.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.009 -175.255 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.65 -35.87 79.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.599 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.548 ' O ' HG13 ' A' ' 73' ' ' ILE . 58.7 mm-40 -59.6 -52.85 63.76 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 177.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.522 ' O ' HG13 ' A' ' 74' ' ' ILE . 32.2 m-70 -52.46 -41.7 63.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.604 178.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 54.3 mt-10 -66.38 -45.64 79.38 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.709 -177.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.0 m -59.13 -47.0 86.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.666 0.269 . . . . 0.0 110.565 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 69' ' ' GLU . 98.3 mt -50.99 -62.32 0.55 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.75 -178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.7 mt -74.59 -24.69 18.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.21 -172.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 23.0 t -68.04 -29.75 68.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.402 HD22 ' N ' ' A' ' 76' ' ' ASN . 0.9 OUTLIER -78.92 -25.17 43.69 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.911 0.386 . . . . 0.0 110.257 176.404 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.531 HD13 HG12 ' A' ' 55' ' ' ILE . 37.8 tp -67.59 -37.84 83.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.941 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.59 -1.49 10.26 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.688 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -107.1 133.71 51.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.848 0.356 . . . . 0.0 110.93 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.561 ' OD1' ' HB3' ' A' ' 82' ' ' SER . 23.9 t-20 -66.19 117.46 43.3 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.462 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.78 -5.6 17.49 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.632 2.221 . . . . 0.0 112.913 -176.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.561 ' HB3' ' OD1' ' A' ' 80' ' ' ASN . 42.1 t -80.31 -9.01 59.73 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 177.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -69.57 -21.67 63.6 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -112.67 108.62 17.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.288 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -83.12 -41.72 18.22 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.259 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -89.36 150.48 22.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.068 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.79 -37.96 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.355 176.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -53.32 -52.0 60.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.575 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -61.23 -43.57 98.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.025 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.415 ' O ' HG13 ' A' ' 94' ' ' ILE . 94.6 mtt180 -64.3 -41.89 96.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.319 -178.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -66.77 -45.71 87.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.137 177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 -38.65 80.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.818 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -70.91 -39.18 72.89 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.921 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 90' ' ' ARG . 70.4 mt -66.07 -32.5 58.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.228 0.537 . . . . 0.0 109.94 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 HD12 ' A' ' 98' ' ' ILE . 4.0 mm? -73.86 -21.25 60.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.968 174.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -68.85 -33.05 73.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.717 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.458 HE21 HG13 ' A' ' 55' ' ' ILE . 2.6 mp0 -67.75 -36.35 80.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.958 0.409 . . . . 0.0 109.988 175.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.522 HD12 HD13 ' A' ' 95' ' ' LEU . 43.2 mt -67.61 -32.54 57.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.149 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.61 -42.96 97.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.614 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.401 HD22 ' HA ' ' A' ' 100' ' ' ASN . 2.6 t-20 -70.4 -28.54 65.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.059 179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 101' ' ' LYS . 55.9 tttm -77.96 -3.06 39.99 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.263 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.93 -21.06 60.74 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.076 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -121.25 155.82 33.82 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.4 tp -79.71 -41.59 26.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.528 ' OE2' ' HA ' ' A' ' 108' ' ' HIS . 31.5 tt0 -68.49 121.05 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -68.21 98.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.184 0.516 . . . . 0.0 111.828 -174.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 39.4 49.71 1.92 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.224 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.528 ' HA ' ' OE2' ' A' ' 105' ' ' GLU . 34.5 m170 69.98 137.92 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.191 -0.913 . . . . 0.0 113.303 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -69.56 128.63 37.17 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 169.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -57.22 -41.76 80.09 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -168.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.2 p80 . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.183 -0.913 . . . . 0.0 109.395 177.466 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.661 ' HG3' ' H ' ' A' ' 2' ' ' PHE . 45.2 tpp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.661 ' H ' ' HG3' ' A' ' 1' ' ' MET . 63.5 m-85 -100.04 148.6 24.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.545 0.212 . . . . 0.0 110.723 -177.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.6 p -121.29 132.22 54.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.139 0.495 . . . . 0.0 110.943 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.6 128.87 55.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.356 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.461 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 6.0 ttpm? -114.13 121.63 44.36 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.626 0.25 . . . . 0.0 110.502 -179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.628 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 55.2 tp -62.84 124.95 22.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.99 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.0 pt -120.43 5.42 6.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.761 -177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -132.89 104.76 6.74 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.365 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.86 -121.27 5.64 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.034 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.629 ' HD2' ' HB3' ' A' ' 21' ' ' ALA . 41.9 tptt -169.38 -45.66 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 p -135.56 113.45 11.09 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.561 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -123.12 112.8 18.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.273 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.503 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 28.2 t-20 -92.63 107.79 19.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.941 0.401 . . . . 0.0 110.528 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.32 110.3 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.733 177.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.7 mtt 65.17 -80.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.808 0.693 . . . . 0.0 111.091 -177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -137.31 -1.93 2.43 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.237 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -104.64 115.98 47.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -178.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 28.3 m -89.38 106.25 18.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.927 0.394 . . . . 0.0 110.396 177.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -85.38 146.6 26.91 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.211 178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.526 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 75.7 mtt180 -121.25 132.46 54.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.193 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.629 ' HB3' ' HD2' ' A' ' 10' ' ' LYS . . . -59.51 112.93 1.96 Allowed 'General case' 0 C--O 1.238 0.463 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.024 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.51 -12.03 25.76 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.058 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.7 t -116.63 119.55 62.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.649 0.261 . . . . 0.0 111.129 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.423 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 9.7 m -82.29 123.24 28.88 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 173.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -119.1 143.94 46.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.75 0.31 . . . . 0.0 110.642 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -70.74 131.24 43.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.421 -175.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.2 m -131.19 151.4 78.81 Favored Pre-proline 0 C--O 1.235 0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.537 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.547 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.9 Cg_exo -68.43 166.16 26.54 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.81 2.34 . . . . 0.0 111.671 175.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -62.14 -33.9 75.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.286 -175.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.96 -46.25 90.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.775 0.321 . . . . 0.0 110.63 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.547 HD12 ' HD2' ' A' ' 28' ' ' PRO . 65.3 mt -74.54 -23.22 58.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.697 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -62.63 -46.48 88.06 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 176.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.466 ' O ' ' HB3' ' A' ' 36' ' ' ASN . 24.5 tp10 -76.22 -34.61 59.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.216 0.531 . . . . 0.0 110.198 177.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.457 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 49.5 t80 -58.55 -48.55 80.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.269 177.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD22 ' CE2' ' A' ' 41' ' ' PHE . 79.6 mt -79.55 -15.19 58.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.684 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.466 ' HB3' ' O ' ' A' ' 33' ' ' GLU . 45.1 t30 -62.01 -40.56 96.1 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 173.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.5 5.32 31.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.915 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.475 ' HB2' ' HA ' ' A' ' 35' ' ' LEU . 32.0 m-80 -123.9 97.51 41.05 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.824 0.345 . . . . 0.0 110.427 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -70.77 63.93 2.39 Favored 'Trans proline' 0 CA--C 1.531 0.328 0 C-N-CA 123.4 2.733 . . . . 0.0 113.359 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.435 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 81.1 m-85 -120.43 -14.02 8.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.011 173.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.568 ' CE2' HD22 ' A' ' 35' ' ' LEU . 57.3 m-85 -129.21 151.42 49.9 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.211 -167.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.7 tt -97.24 118.45 43.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 166.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.6 mt -94.35 129.28 41.11 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.227 -175.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 m -142.62 147.17 35.37 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 -176.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.69 105.03 12.57 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 172.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -106.72 111.37 23.87 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.338 -175.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.9 tp -98.35 147.14 24.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.644 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.27 89.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.258 0.552 . . . . 0.0 110.215 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -156.51 -41.1 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.689 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -92.4 8.18 39.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.885 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -144.25 134.74 24.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.759 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -127.86 172.63 10.69 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -123.36 80.2 53.33 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 0.0 110.157 -177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -96.04 57.25 0.16 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.633 2.889 . . . . 0.0 113.673 -171.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -174.94 35.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 122.293 1.044 . . . . 0.0 109.496 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.3 t30 -156.72 82.41 0.95 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.989 -172.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.413 ' N ' HD11 ' A' ' 98' ' ' ILE . 70.1 m-85 -142.37 150.06 40.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.687 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.937 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 14.0 m -60.82 138.75 58.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.562 0.22 . . . . 0.0 111.155 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.63 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -59.1 -37.43 77.13 Favored 'General case' 0 C--O 1.225 -0.213 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.171 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.55 ' H ' HG22 ' A' ' 58' ' ' THR . 18.6 m -70.01 -20.51 63.27 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.695 177.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.937 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 47.8 mm-40 -80.93 -45.62 16.42 Favored 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 120.227 -0.589 . . . . 0.0 109.713 173.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 87.4 mt -68.03 -18.58 64.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.842 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 59' ' ' GLU . 1.6 mptm? -67.01 -33.46 75.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.943 0.402 . . . . 0.0 110.494 174.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.74 -22.01 27.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.049 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.9 mtp -73.32 136.69 44.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.88 0.371 . . . . 0.0 110.423 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -70.65 167.36 18.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.261 -174.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 1.5 tmmt? -60.51 -41.24 93.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.559 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.9 68.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.862 176.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' O ' HG13 ' A' ' 73' ' ' ILE . 13.7 mm-40 -67.45 -50.01 61.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.204 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.487 ' HE1' HD13 ' A' ' 91' ' ' ILE . 85.2 m-70 -52.14 -44.5 64.59 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.698 175.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' CG ' ' A' ' 81' ' ' PRO . 86.4 mt-10 -60.42 -53.78 53.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.679 176.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.5 m -51.96 -44.39 63.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.972 0.415 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 69' ' ' GLU . 90.1 mt -59.72 -62.52 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.711 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.588 HD12 ' HB3' ' A' ' 81' ' ' PRO . 4.4 mt -78.13 -10.4 12.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.627 -170.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m -80.82 -33.22 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.129 -0.357 . . . . 0.0 110.052 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -70.35 -27.11 64.09 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.108 0.48 . . . . 0.0 109.794 174.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.4 tp -67.3 -23.35 65.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.968 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.41 18.61 52.22 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.579 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -40.08 6.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.659 0.229 . . . . 0.0 110.655 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 67.91 105.64 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.786 0.679 . . . . 0.0 110.832 -176.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.588 ' HB3' HD12 ' A' ' 74' ' ' ILE . 90.2 Cg_endo -84.2 34.17 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.805 2.337 . . . . 0.0 112.864 -177.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 p -76.41 -26.37 55.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.483 177.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.28 -31.99 62.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.435 178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -82.56 108.86 16.27 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -82.57 -31.79 28.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.273 -175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.881 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 86.1 m-20 -92.27 141.69 28.29 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.62 ' O ' HG12 ' A' ' 91' ' ' ILE . . . -62.64 -37.73 87.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.276 178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -60.4 -37.76 81.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.468 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.881 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 31.2 mm-40 -65.81 -35.05 79.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.465 0.65 . . . . 0.0 109.62 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -70.53 -35.4 73.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 176.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 87' ' ' ALA . 37.5 mm -61.93 -54.07 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 96' ' ' LYS . . . -58.31 -40.27 81.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.869 -175.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -67.7 -46.15 73.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.525 0.202 . . . . 0.0 111.067 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.9 mt -65.76 -41.49 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.14 0.495 . . . . 0.0 109.885 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.523 HD13 HD12 ' A' ' 98' ' ' ILE . 4.2 mm? -67.99 -29.65 68.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.111 178.179 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 38.5 tptt -72.52 -18.43 61.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.058 0.456 . . . . 0.0 110.778 -177.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.472 ' O ' ' HG3' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -83.15 -30.28 27.97 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.523 HD12 HD13 ' A' ' 95' ' ' LEU . 39.4 mt -71.19 -35.61 58.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 173.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -63.61 -25.11 68.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.532 176.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -84.99 -17.31 37.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.246 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 97' ' ' GLN . 67.7 mttm -94.83 97.52 10.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.293 179.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 146.93 42.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.217 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 68.49 1.31 2.9 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 173.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.7 mp 50.82 57.69 6.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.412 0.625 . . . . 0.0 109.841 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.06 160.14 32.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.304 -173.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -161.95 80.93 0.56 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.481 176.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -89.47 142.27 27.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.274 -173.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -149.09 116.96 6.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.286 177.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -79.11 166.5 22.2 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 176.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -74.98 71.98 2.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.151 0.501 . . . . 0.0 109.826 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 C--O 1.244 0.785 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.116 -178.42 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -92.33 113.11 25.3 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.8 p -114.9 148.36 38.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.966 0.412 . . . . 0.0 110.618 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . . . -130.95 134.54 46.83 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.133 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.786 ' HE3' ' OG ' ' A' ' 24' ' ' SER . 1.6 ttmp? -120.16 118.75 31.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.135 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.686 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 40.0 tp -71.3 128.2 35.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.821 HG13 ' HG3' ' A' ' 8' ' ' LYS . 41.5 pt -113.74 -17.16 8.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.866 0.365 . . . . 0.0 110.986 -177.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.821 ' HG3' HG13 ' A' ' 7' ' ' ILE . 96.5 mttt -133.1 138.69 46.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -177.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.66 -13.93 24.87 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.854 178.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.6 tttm 73.92 -52.89 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.532 0.733 . . . . 0.0 110.924 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 58.5 m -151.94 119.33 5.98 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.93 177.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.458 ' CE2' HG22 ' A' ' 14' ' ' VAL . 30.2 t80 -141.19 126.33 18.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.992 0.425 . . . . 0.0 110.731 -178.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -92.14 125.49 36.84 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.912 178.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.458 HG22 ' CE2' ' A' ' 12' ' ' TYR . 47.9 t -104.81 104.94 17.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 175.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.5 mtt 65.41 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.112 -175.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.83 0.04 2.07 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.517 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.7 mp -101.3 123.48 54.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 m -83.31 116.61 22.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.943 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 96.9 m-85 -106.23 140.61 38.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.745 0.307 . . . . 0.0 110.189 175.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -127.66 148.28 50.39 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.686 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -59.21 112.29 1.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.624 0.249 . . . . 0.0 111.167 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.08 5.28 57.36 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.387 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.6 112.37 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.997 0.427 . . . . 0.0 110.15 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.786 ' OG ' ' HE3' ' A' ' 5' ' ' LYS . 16.0 m -92.45 123.98 36.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.64 -177.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.63 150.41 51.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.819 0.343 . . . . 0.0 111.001 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 m -79.78 138.81 37.36 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.127 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.52 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 34.7 m -134.93 158.23 75.39 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.723 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.502 ' HD2' HD12 ' A' ' 31' ' ' LEU . 16.6 Cg_exo -68.95 171.32 13.76 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.769 2.313 . . . . 0.0 111.577 173.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.502 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 11.4 tmtt? -66.19 -31.13 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -177.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -55.84 -53.81 52.22 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.451 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.52 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 65.3 mt -70.23 -34.69 73.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.214 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -56.18 -46.77 79.26 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -71.53 -43.15 66.98 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.895 0.379 . . . . 0.0 110.574 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -58.0 -38.52 76.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.662 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.531 HD22 ' CE1' ' A' ' 41' ' ' PHE . 78.6 mt -88.75 -9.01 53.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.047 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -76.44 -23.94 53.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 172.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -84.41 -12.95 53.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.526 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -112.41 103.27 55.34 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.659 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.55 11.44 0.48 Allowed 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.411 2.74 . . . . 0.0 114.195 -173.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -85.1 -3.72 58.9 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.582 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 79.1 m-85 -118.82 131.47 56.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.11 -176.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.564 HG13 HD13 ' A' ' 7' ' ' ILE . 27.9 mt -97.45 104.12 15.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 166.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.405 ' HA ' ' HA ' ' A' ' 4' ' ' ALA . 4.7 mp -88.74 162.44 16.24 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.357 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.5 m -149.91 154.31 38.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.001 -177.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -129.35 108.93 10.68 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -101.32 126.77 48.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.82 106.24 0.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.725 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -139.3 137.58 35.97 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 175.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.22 146.87 53.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.328 0.585 . . . . 0.0 111.679 -173.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -77.81 -174.93 3.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.792 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.428 ' HE3' ' HB2' ' A' ' 51' ' ' LYS . 25.8 ttmt -74.29 157.47 35.73 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -75.47 -173.19 2.04 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -172.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -55.43 126.45 62.78 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.342 -171.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.551 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 71.8 Cg_endo -77.71 46.94 2.17 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 123.269 2.646 . . . . 0.0 112.465 178.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.669 HG12 HD13 ' A' ' 77' ' ' LEU . 9.6 tp -170.7 22.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.454 1.121 . . . . 0.0 109.042 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.754 HD22 HG12 ' A' ' 98' ' ' ILE . 2.6 t-20 -159.11 98.86 1.47 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.679 -173.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.551 ' OH ' ' HA ' ' A' ' 54' ' ' PRO . 95.9 m-85 -140.11 -174.66 3.99 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.51 -176.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.729 ' HB ' ' HB3' ' A' ' 61' ' ' GLU . 3.0 m -79.59 129.47 34.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.583 ' HB3' HD21 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -63.29 -39.65 95.17 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.822 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.51 ' HA ' ' HE3' ' A' ' 63' ' ' LYS . 50.2 m -64.95 -29.3 70.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.978 0.418 . . . . 0.0 109.971 174.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.729 ' HB3' ' HB ' ' A' ' 58' ' ' THR . 39.7 tt0 -76.23 -38.75 55.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.96 -27.52 63.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.245 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 60' ' ' SER . 48.3 mtmt -76.42 -1.24 26.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.057 0.456 . . . . 0.0 110.579 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.26 26.46 8.2 Favored Glycine 0 N--CA 1.448 -0.563 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 172.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.506 ' HB3' ' HG3' ' A' ' 69' ' ' GLU . 24.1 mmt -119.33 161.71 20.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.554 -0.323 . . . . 0.0 110.444 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HB2' ' OE1' ' A' ' 69' ' ' GLU . 16.2 m-80 -91.62 -167.81 1.88 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.472 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -79.46 -35.22 40.69 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.229 -177.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.12 77.23 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.409 0.443 . . . . 0.0 112.017 -171.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HG3' ' HB3' ' A' ' 65' ' ' MET . 2.6 pm0 -63.03 -47.0 84.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.775 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.52 ' HE1' HG12 ' A' ' 91' ' ' ILE . 19.7 m-70 -55.31 -41.37 72.28 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.565 0.222 . . . . 0.0 111.079 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.485 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 42.6 mt-10 -65.73 -50.15 65.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.986 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 m -58.59 -38.11 77.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.481 HG23 ' O ' ' A' ' 54' ' ' PRO . 69.1 mt -54.61 -61.97 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.407 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.518 HD12 ' HB3' ' A' ' 81' ' ' PRO . 2.0 mt -79.3 -21.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.983 -170.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 30.5 p -71.19 -25.5 62.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.541 -0.464 . . . . 0.0 109.779 175.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -76.25 -33.35 59.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.107 172.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.669 HD13 HG12 ' A' ' 55' ' ' ILE . 47.2 tp -62.47 -38.89 91.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.117 0.484 . . . . 0.0 110.708 174.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.32 -46.99 1.04 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.233 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.521 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 48.8 ttt85 -77.37 111.7 13.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.134 0.492 . . . . 0.0 109.768 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -62.32 130.66 93.33 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.085 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.518 ' HB3' HD12 ' A' ' 74' ' ' ILE . 91.9 Cg_endo -86.53 24.92 0.71 Allowed 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 123.254 2.636 . . . . 0.0 112.718 -177.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.2 m -73.65 -36.81 65.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.921 0.391 . . . . 0.0 110.344 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -73.59 -27.42 61.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.535 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.421 ' HD1' ' HA ' ' A' ' 81' ' ' PRO . 87.7 m-85 -82.52 108.88 16.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.293 177.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 37.3 ttmt -99.37 -54.61 2.91 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.05 -171.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -83.15 158.47 22.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.903 -174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.11 73.23 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.173 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -50.44 -49.23 55.57 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.637 0.586 . . . . 0.0 110.882 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -63.18 -49.39 74.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.981 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.7 mtt180 -64.2 -43.52 94.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.085 -176.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.52 HG12 ' HE1' ' A' ' 70' ' ' HIS . 91.1 mt -71.3 -43.88 73.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.178 -176.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -58.81 -40.21 83.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 111.174 -178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.521 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 41.9 t80 -68.1 -42.57 80.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.47 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.503 ' O ' HG13 ' A' ' 98' ' ' ILE . 78.9 mt -60.92 -39.71 82.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 176.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.583 HD21 ' HB3' ' A' ' 59' ' ' GLU . 38.3 mt -55.55 -40.73 72.26 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.025 177.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 92' ' ' ALA . 66.0 mttm -60.33 -34.27 73.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.391 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -83.55 -18.99 36.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.014 0.435 . . . . 0.0 110.621 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.754 HG12 HD22 ' A' ' 56' ' ' ASN . 78.1 mt -70.07 -41.79 79.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.912 176.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -75.84 -48.22 22.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.559 176.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -120.22 88.4 2.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.125 0.488 . . . . 0.0 111.117 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -90.6 -44.15 9.72 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 78.06 -61.2 3.8 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-N 115.505 -0.77 . . . . 0.0 113.89 172.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.752 ' HG2' ' H ' ' A' ' 104' ' ' LEU . 21.3 tt0 66.68 -156.85 0.24 Allowed 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -172.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.752 ' H ' ' HG2' ' A' ' 103' ' ' GLU . 8.2 mp 56.75 62.74 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.263 0.554 . . . . 0.0 109.545 -175.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.34 -47.07 74.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.119 -173.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -162.29 118.36 1.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.111 0.481 . . . . 0.0 111.011 -176.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.532 ' O ' ' HB3' ' A' ' 108' ' ' HIS . 76.1 t60 -161.6 143.61 11.66 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.527 -0.761 . . . . 0.0 108.976 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.532 ' HB3' ' O ' ' A' ' 107' ' ' HIS . 36.9 t60 78.84 -37.92 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.602 0.564 . . . . 0.0 110.418 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -68.85 120.19 14.38 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 172.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 30.0 p80 -134.57 177.12 8.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.427 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.337 -0.839 . . . . 0.0 109.215 173.438 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -124.08 161.45 25.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.727 0.299 . . . . 0.0 110.571 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 p -127.42 139.55 52.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.431 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.17 128.2 54.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -111.32 105.5 14.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.018 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 50.6 tp -65.72 116.89 7.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.562 HG21 HG13 ' A' ' 42' ' ' ILE . 42.5 pt -107.1 -29.87 2.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.811 0.339 . . . . 0.0 111.58 -175.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 40' ' ' TYR . 50.4 mttm -106.5 128.91 54.47 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.322 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.24 -128.51 8.57 Favored Glycine 0 N--CA 1.441 -0.981 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.126 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -170.12 -46.94 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -175.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.26 113.49 6.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.685 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -123.1 104.21 9.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.338 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 23.8 t-20 -90.23 122.2 32.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.848 0.356 . . . . 0.0 111.034 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.8 t -119.99 111.78 34.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.763 174.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 65.1 mtt 64.52 -95.29 0.04 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.884 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.94 17.42 6.33 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.056 -0.593 . . . . 0.0 111.712 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 HD11 ' A' ' 31' ' ' LEU . 4.6 mp -123.42 110.87 27.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 30.5 m -90.53 107.34 19.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.631 177.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 91.9 m-85 -84.91 151.02 24.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.052 179.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 46.6 mtm180 -133.83 145.68 49.93 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.562 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -54.61 114.82 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.993 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.84 -7.16 67.54 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.626 177.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.6 t -100.82 125.43 54.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.873 0.368 . . . . 0.0 111.275 -176.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.4 m -94.59 121.73 36.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.122 176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -124.57 146.06 49.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.601 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.8 m -75.13 126.71 31.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.6 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.9 m -122.75 154.33 63.65 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-O 120.678 0.275 . . . . 0.0 111.45 -176.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.565 ' HD2' HD12 ' A' ' 31' ' ' LEU . 21.2 Cg_exo -66.86 164.23 30.4 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.8 2.334 . . . . 0.0 111.015 172.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -64.19 -32.58 74.21 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.001 -175.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -54.57 -52.02 63.44 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.995 0.426 . . . . 0.0 110.489 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 28' ' ' PRO . 49.3 mt -67.92 -33.63 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.472 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB3' ' A' ' 43' ' ' LEU . 87.4 t80 -59.13 -44.13 92.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.879 0.371 . . . . 0.0 110.305 178.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -77.7 -40.17 42.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -59.76 -40.43 88.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.329 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -87.67 -13.48 42.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 8.1 t30 -63.83 -36.9 85.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.16 8.18 16.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.468 176.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 31.5 m-80 -127.99 91.93 43.46 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.118 0.485 . . . . 0.0 110.157 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -75.14 57.0 4.51 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.745 2.963 . . . . 0.0 114.643 -169.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.53 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 3.3 p90 -133.58 22.36 3.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.649 0.738 . . . . 0.0 110.121 170.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.44 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.79 148.93 50.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.766 175.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 HG21 ' A' ' 7' ' ' ILE . 50.3 mt -97.03 110.09 24.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 163.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 68.6 mt -91.84 133.1 35.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.367 -175.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -138.29 168.94 18.68 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.419 -177.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -136.5 104.86 5.71 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 167.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -104.57 167.62 9.62 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.048 -171.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -92.95 166.74 12.24 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.847 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -130.9 -53.99 1.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.468 178.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -73.09 106.91 5.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.795 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -126.98 -5.22 6.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.327 0.584 . . . . 0.0 109.907 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.467 ' C ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -96.48 16.59 18.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.756 -174.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -76.44 176.63 8.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.746 0.308 . . . . 0.0 110.754 -175.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.35 151.16 41.21 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.815 -177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.423 ' O ' ' HB ' ' A' ' 55' ' ' ILE . 11.9 Cg_exo -71.0 94.46 0.64 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.938 2.426 . . . . 0.0 113.033 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.83 HG12 HD13 ' A' ' 77' ' ' LEU . 9.5 tp -179.47 26.67 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 CA-C-O 122.047 0.927 . . . . 0.0 109.716 175.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.538 ' HB3' HG12 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -163.78 98.09 0.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.654 -174.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -142.3 160.13 40.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.502 -177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.498 ' HB ' ' H ' ' A' ' 61' ' ' GLU . 1.7 m -57.16 137.3 56.04 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.467 0.479 . . . . 0.0 110.175 175.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HB3' HD11 ' A' ' 95' ' ' LEU . 0.6 OUTLIER -62.81 -31.17 72.11 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.369 -0.532 . . . . 0.0 109.865 176.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.2 t -64.87 -41.38 95.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.599 172.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -68.35 -42.17 79.65 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.35 179.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.456 HD23 ' SD ' ' A' ' 65' ' ' MET . 99.9 mt -66.39 -32.62 74.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.41 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HG3' HD13 ' A' ' 91' ' ' ILE . 43.1 mtmt -76.71 -16.96 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.055 0.455 . . . . 0.0 110.538 175.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -100.05 23.27 36.63 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.636 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.1 mtt -117.67 160.71 20.85 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.271 0.558 . . . . 0.0 111.042 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.572 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 38.6 t30 -74.02 152.54 39.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.055 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 49.4 mtmt -52.45 -47.07 66.64 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.337 177.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.3 64.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.776 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 26.8 mm-40 -66.21 -44.45 83.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.579 ' O ' HG13 ' A' ' 74' ' ' ILE . 76.3 m-70 -57.64 -42.84 84.26 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.09 0.472 . . . . 0.0 110.247 176.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' ' 81' ' ' PRO . 4.3 mm-40 -63.5 -46.25 86.96 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.65 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.8 p -72.57 -36.18 68.14 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.643 -177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 69' ' ' GLU . 81.7 mt -56.6 -55.86 17.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.18 0.514 . . . . 0.0 110.716 177.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 70' ' ' HIS . 2.4 mt -77.14 -18.58 14.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.019 0.438 . . . . 0.0 110.537 -175.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.1 t -64.65 -38.13 89.96 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -66.11 -34.97 79.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.297 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.83 HD13 HG12 ' A' ' 55' ' ' ILE . 58.2 tp -59.06 -34.89 72.48 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.183 0.515 . . . . 0.0 110.545 174.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.22 14.73 11.4 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.036 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.438 ' HD3' ' OH ' ' A' ' 93' ' ' TYR . 48.9 ttt180 -145.78 92.76 2.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.147 0.498 . . . . 0.0 110.221 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.578 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 51.0 t30 -58.67 132.48 85.99 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.676 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.578 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 85.2 Cg_exo -44.95 84.63 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 123.987 3.125 . . . . 0.0 113.575 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.3 t -78.83 108.63 12.41 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.946 -1.025 . . . . 0.0 110.925 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.5 t70 51.68 62.05 2.9 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 123.978 0.799 . . . . 0.0 111.731 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -116.97 108.09 15.36 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 171.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -99.6 -32.4 11.11 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.065 0.46 . . . . 0.0 110.246 -175.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -72.1 124.33 24.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.98 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.43 88.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.888 -178.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.56 -25.87 67.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.288 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -67.38 -42.68 82.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.685 0.279 . . . . 0.0 110.551 -177.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 48.8 mtt-85 -62.07 -43.59 98.5 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.372 0.606 . . . . 0.0 109.779 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.411 HD13 ' HG3' ' A' ' 63' ' ' LYS . 45.1 mt -67.63 -42.51 86.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.229 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.86 -34.35 78.17 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.271 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.438 ' OH ' ' HD3' ' A' ' 79' ' ' ARG . 30.1 t80 -68.91 -38.84 79.83 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.206 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.445 ' O ' HG13 ' A' ' 98' ' ' ILE . 73.6 mt -65.82 -47.16 86.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.02 176.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 59' ' ' GLU . 95.1 mt -62.09 -38.36 88.58 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.082 0.468 . . . . 0.0 111.013 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -61.85 -36.5 81.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.426 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -72.91 -22.51 60.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.836 -179.383 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.538 HG12 ' HB3' ' A' ' 56' ' ' ASN . 53.6 mt -73.57 -40.31 54.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 109.686 175.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -72.64 -28.49 62.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.156 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.413 ' N ' HD22 ' A' ' 100' ' ' ASN . 0.9 OUTLIER -95.44 13.01 27.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.807 177.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 97' ' ' GLN . 83.5 tttt -96.08 112.13 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.923 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 132.17 83.18 0.24 Allowed Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -175.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -64.73 106.66 1.24 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.829 0.347 . . . . 0.0 111.279 -175.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.4 tt -82.33 74.99 9.27 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -106.13 157.64 17.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.021 -177.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -67.24 154.61 40.88 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.701 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -57.29 128.06 35.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.51 72.65 5.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.212 0.53 . . . . 0.0 111.728 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -90.07 10.65 23.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.572 175.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -83.46 13.41 4.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.755 177.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 . . . . . 0 C--O 1.245 0.833 0 CA-C-O 118.486 -0.768 . . . . 0.0 109.742 176.2 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 121.047 0.451 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.417 ' HB3' ' CD1' ' A' ' 32' ' ' TYR . 61.3 m-85 -124.29 121.44 35.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.484 176.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.4 t -126.37 147.39 49.77 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.63 135.23 54.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.933 0.397 . . . . 0.0 110.918 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -119.4 118.35 30.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.462 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.66 130.42 43.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 42' ' ' ILE . 40.4 pt -120.14 -0.52 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.835 0.35 . . . . 0.0 111.408 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 88.7 tttt -135.71 121.54 19.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.79 -174.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 100.43 -125.05 8.44 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.45 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 20' ' ' ARG . 38.6 ttmt -155.37 -52.08 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.5 m -144.29 126.48 15.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.907 0.384 . . . . 0.0 111.168 -178.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -142.5 131.04 22.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.033 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 65.1 t30 -93.92 120.54 34.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.113 0.482 . . . . 0.0 111.166 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 90.7 t -99.89 95.17 3.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.914 176.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 67.3 mtt 62.8 -81.02 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.826 -176.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -129.17 -2.13 5.59 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.96 177.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -103.57 105.62 18.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 -178.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 13' ' ' ASN . 4.1 m -86.2 117.69 25.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.878 0.371 . . . . 0.0 110.545 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 25' ' ' GLN . 96.1 m-85 -103.88 152.95 21.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -178.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 10' ' ' LYS . 36.5 mtm180 -124.09 139.77 53.61 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.821 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.774 ' HA ' ' HB3' ' A' ' 6' ' ' LEU . . . -51.13 118.63 3.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.108 0.48 . . . . 0.0 111.24 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.89 -22.46 35.23 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.3 -178.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -93.16 122.4 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 110.698 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -95.19 125.55 39.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.746 175.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 19' ' ' PHE . 25.9 mt-30 -130.87 140.72 50.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.061 -179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.0 p -67.7 133.25 48.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.741 -175.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -121.96 149.63 54.29 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.327 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.544 ' HD2' HD12 ' A' ' 31' ' ' LEU . 22.5 Cg_exo -65.74 163.12 31.72 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.766 2.311 . . . . 0.0 110.774 171.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -63.27 -29.04 70.44 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.433 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.75 -53.69 50.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.437 175.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.544 HD12 ' HD2' ' A' ' 28' ' ' PRO . 67.2 mt -67.98 -25.55 65.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.038 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 36' ' ' ASN . 81.2 t80 -59.68 -47.26 86.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 176.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -73.21 -38.75 65.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.807 0.337 . . . . 0.0 110.628 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.414 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 86.9 t80 -58.29 -47.64 83.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.914 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.55 ' HB2' HD21 ' A' ' 43' ' ' LEU . 89.2 mt -80.63 -22.21 40.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.035 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 32' ' ' TYR . 53.3 t30 -63.29 -28.79 70.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.512 0.673 . . . . 0.0 109.729 174.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -81.39 0.05 39.19 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.59 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -121.76 116.61 30.28 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.205 0.526 . . . . 0.0 111.258 -176.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.59 10.37 2.25 Favored 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 123.169 2.579 . . . . 0.0 114.605 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 5.4 p90 -107.02 12.09 29.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.438 0.637 . . . . 0.0 110.482 177.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -127.35 127.58 44.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.325 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 7' ' ' ILE . 50.4 mt -97.52 109.96 24.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 168.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.55 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.2 mp -94.83 149.78 20.88 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.822 -178.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.7 m -128.79 117.3 20.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -101.39 122.97 44.7 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.484 172.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -102.44 108.31 19.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.091 0.472 . . . . 0.0 110.22 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.9 mp -86.5 96.22 9.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.577 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -120.33 23.78 10.73 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.068 177.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -85.39 -50.41 7.33 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.92 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -139.85 82.19 1.86 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 174.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -97.13 -12.58 22.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.21 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.463 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 11.2 m-20 -96.89 176.38 5.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.458 178.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -90.77 113.12 56.81 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.816 -171.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 52' ' ' ASP . 86.6 Cg_endo -100.46 -175.55 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 123.485 2.79 . . . . 0.0 111.967 172.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.666 HG12 HD22 ' A' ' 77' ' ' LEU . 10.7 tp 38.78 61.2 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.863 0.865 . . . . 0.0 112.951 173.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -174.43 87.52 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.586 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -142.86 161.94 36.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.691 0.281 . . . . 0.0 110.736 -175.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.643 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 2.0 m -74.19 143.74 45.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.627 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -34.69 78.77 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.357 0.599 . . . . 0.0 109.959 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.6 m -75.83 -25.95 56.74 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.582 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.643 ' CB ' ' HB ' ' A' ' 58' ' ' THR . 56.2 tt0 -77.19 -44.81 28.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.405 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.688 ' HB3' ' HE1' ' A' ' 70' ' ' HIS . 89.9 mt -65.2 -33.6 76.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.585 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -72.45 -12.75 61.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.843 176.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.56 28.48 13.26 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 176.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.478 ' SD ' HD23 ' A' ' 62' ' ' LEU . 58.2 mtt -119.67 -171.24 2.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 111.078 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.53 ' ND2' ' H ' ' A' ' 68' ' ' ALA . 4.9 t30 -114.7 162.92 16.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.668 176.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 18.9 ptmt -56.05 -40.24 73.21 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.53 ' H ' ' ND2' ' A' ' 66' ' ' ASN . . . -56.72 -49.68 74.44 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -170.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.536 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 pm0 -59.39 -46.88 87.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.077 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.688 ' HE1' ' HB3' ' A' ' 62' ' ' LEU . 89.0 m-70 -50.38 -50.7 50.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.972 0.415 . . . . 0.0 110.922 177.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.556 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 4.0 mm-40 -61.88 -43.66 98.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.704 -176.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 m -63.03 -44.4 96.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.742 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.8 mt -52.63 -58.33 2.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.919 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.478 HD12 ' HB3' ' A' ' 81' ' ' PRO . 0.8 OUTLIER -75.48 -21.88 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.043 -172.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.9 m -70.63 -23.95 62.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.848 0.356 . . . . 0.0 110.699 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -82.96 -30.11 28.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.101 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.666 HD22 HG12 ' A' ' 55' ' ' ILE . 51.2 tp -67.75 -37.97 82.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.848 174.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 133.94 -60.82 0.65 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.016 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 93' ' ' TYR . 62.1 ttt180 -65.92 108.1 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 80' ' ' ASN . 11.2 m120 -63.74 142.36 98.04 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.649 -175.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 55.2 Cg_endo -67.13 -7.6 19.31 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 123.569 2.846 . . . . 0.0 112.51 -176.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.7 m -64.25 -17.58 63.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.77 179.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -76.2 -20.34 57.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.257 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -111.11 112.72 24.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.016 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.75 -36.04 32.51 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -173.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.4 ' HB3' ' OD1' ' A' ' 88' ' ' ASP . 66.8 t30 -107.01 164.22 12.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.74 0.305 . . . . 0.0 110.642 -176.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.436 ' HA ' ' HD2' ' A' ' 90' ' ' ARG . . . -64.89 -34.12 77.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.847 -177.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.4 ' OD1' ' HB3' ' A' ' 86' ' ' ASN . 22.8 p-10 -64.24 -47.4 79.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.207 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -60.25 -38.25 82.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.911 0.386 . . . . 0.0 110.843 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 87' ' ' ALA . 55.3 mtt85 -58.78 -52.22 66.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.431 175.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.77 -44.54 96.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.258 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.24 -41.32 75.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.432 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 79' ' ' ARG . 27.2 t80 -72.58 -34.86 67.74 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.998 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.8 mt -67.77 -41.87 85.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 98' ' ' ILE . 4.4 mm? -65.71 -38.53 89.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.766 176.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -57.33 -37.71 72.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.929 177.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -7.77 59.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.948 -175.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 95' ' ' LEU . 27.9 mt -72.91 -44.82 57.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 173.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -78.94 -13.54 59.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.571 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -61.39 -25.26 67.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.708 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -63.94 120.93 12.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.497 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -122.98 -32.89 0.88 Allowed Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.006 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -111.08 85.2 2.07 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.054 0.454 . . . . 0.0 110.11 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 67.9 tp -103.27 -47.32 4.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.13 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.405 ' HB3' ' H ' ' A' ' 106' ' ' HIS . 22.8 mt-10 -100.98 -160.75 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.618 178.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.405 ' H ' ' HB3' ' A' ' 105' ' ' GLU . 10.6 p80 -122.73 87.85 2.82 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.395 0.617 . . . . 0.0 111.585 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -136.54 8.84 3.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.798 0.809 . . . . 0.0 108.868 170.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 66.6 t60 -103.66 21.22 16.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.289 -178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -91.38 -20.49 21.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.766 -174.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -109.8 119.53 39.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.797 0.332 . . . . 0.0 111.753 -172.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.62 -0.705 . . . . 0.0 109.538 174.734 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.514 ' HG3' ' OD1' ' A' ' 48' ' ' ASN . 64.6 mtm . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -114.1 131.34 56.44 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.9 p -122.9 136.35 54.83 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.771 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -119.4 117.72 29.25 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.657 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.448 ' HB3' ' CG2' ' A' ' 42' ' ' ILE . 34.9 ttpt -106.63 121.22 43.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.062 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.825 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 26.0 tp -66.42 116.08 7.04 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.557 HG13 ' HG3' ' A' ' 8' ' ' LYS . 31.9 pt -106.15 -13.08 9.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 120.96 0.41 . . . . 0.0 111.586 -174.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HG3' HG13 ' A' ' 7' ' ' ILE . 95.2 mttt -130.36 109.88 11.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.183 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.6 -120.49 2.56 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.229 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -171.72 -66.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 m -135.05 113.05 11.06 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.45 ' CE2' HG22 ' A' ' 14' ' ' VAL . 26.1 t80 -133.08 130.55 39.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.95 0.405 . . . . 0.0 111.056 -179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -97.65 125.53 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.831 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 35' ' ' LEU . 44.4 t -112.58 115.89 51.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.421 ' SD ' HD21 ' A' ' 31' ' ' LEU . 61.4 mtt 67.88 -73.85 0.08 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.478 0.711 . . . . 0.0 111.076 -177.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 19.75 0.28 Allowed Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.469 HD13 HD11 ' A' ' 31' ' ' LEU . 3.9 mp -118.15 137.34 52.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.0 m -95.08 118.0 31.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 111.548 -176.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 77.5 m-85 -106.16 140.11 39.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.028 177.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.402 ' HB2' ' HB ' ' A' ' 23' ' ' VAL . 79.3 mtp180 -122.82 142.46 50.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.096 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.825 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -65.54 106.13 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.003 0.43 . . . . 0.0 110.725 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 109.6 -5.38 31.19 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.767 -0.652 . . . . 0.0 112.204 -178.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.402 ' HB ' ' HB2' ' A' ' 20' ' ' ARG . 61.0 t -113.61 122.11 67.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.838 0.351 . . . . 0.0 110.705 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 5' ' ' LYS . 12.4 m -82.13 100.59 9.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.216 -179.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -86.72 142.26 28.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.624 -176.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.5 m -81.1 125.43 30.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.65 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.509 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 33.0 m -130.49 155.82 80.53 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.253 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -74.27 162.22 38.96 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.53 2.153 . . . . 0.0 110.539 170.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' TYR . 83.1 tttt -60.55 -23.81 64.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.61 0.243 . . . . 0.0 110.824 -178.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -56.6 -52.08 66.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.083 0.468 . . . . 0.0 109.893 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.509 ' HB2' ' HB ' ' A' ' 27' ' ' VAL . 59.2 mt -75.78 -29.06 58.63 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.768 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' LYS . 89.8 t80 -57.47 -43.26 83.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.006 0.432 . . . . 0.0 110.513 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -80.09 -40.01 28.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.27 0.557 . . . . 0.0 110.305 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.19 -35.1 76.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.958 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 14' ' ' VAL . 90.3 mt -92.68 -15.72 26.39 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.259 -0.276 . . . . 0.0 110.901 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.43 -37.38 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.0 109.817 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.73 6.61 10.38 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.67 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -116.15 113.78 41.34 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.046 0.451 . . . . 0.0 110.424 178.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.92 23.74 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 123.206 2.604 . . . . 0.0 114.517 -171.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.492 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 6.8 p90 -122.25 16.69 10.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.498 0.666 . . . . 0.0 110.392 175.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.507 ' CZ ' HD13 ' A' ' 6' ' ' LEU . 66.2 m-85 -128.49 135.5 49.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.779 173.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.448 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 14.7 tt -98.81 128.37 50.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mp -114.97 118.17 32.67 Favored 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.166 -0.613 . . . . 0.0 111.371 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -112.34 142.27 45.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.967 -176.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -100.51 105.68 17.14 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.94 23.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.376 0.608 . . . . 0.0 111.749 -173.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.9 mp -83.4 122.78 28.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.778 -177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.514 ' OD1' ' HG3' ' A' ' 1' ' ' MET . 12.0 m120 -97.05 172.39 7.88 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.483 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -90.01 143.94 26.35 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -57.78 137.88 56.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.201 0.524 . . . . 0.0 110.794 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.0 tttp -87.08 -21.43 26.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.051 -171.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -117.09 114.91 24.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.152 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -129.63 114.74 18.06 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 -179.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.5 ' O ' HG22 ' A' ' 55' ' ' ILE . 17.2 Cg_endo -57.18 142.43 94.48 Favored 'Trans proline' 0 CA--C 1.529 0.25 0 C-N-CA 123.188 2.592 . . . . 0.0 113.436 -173.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' O ' ' A' ' 54' ' ' PRO . 7.6 tp 52.29 26.84 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.389 1.075 . . . . 0.0 111.951 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.427 ' HB2' ' HE3' ' A' ' 101' ' ' LYS . 6.2 t30 -147.62 80.75 1.5 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.448 0.642 . . . . 0.0 109.68 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -138.23 159.36 42.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.712 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -77.59 148.38 35.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.631 174.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 35.5 tt0 -57.43 -42.76 83.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 176.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m -59.85 -32.67 70.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.189 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -75.66 -37.27 59.75 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 121.102 0.477 . . . . 0.0 110.393 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.469 ' HB3' ' CE1' ' A' ' 70' ' ' HIS . 85.8 mt -81.25 -18.99 44.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.957 -177.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' A' ' 59' ' ' GLU . 31.2 mmtp -65.15 -29.81 70.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.973 0.416 . . . . 0.0 110.996 177.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.09 2.52 79.27 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.358 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.43 ' SD ' HD23 ' A' ' 62' ' ' LEU . 65.8 mtt -103.19 137.78 40.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.778 0.323 . . . . 0.0 110.222 179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.461 ' O ' ' HD2' ' A' ' 70' ' ' HIS . 39.0 m-80 -74.78 171.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.776 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.572 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 24.1 pttm -58.2 -36.97 73.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.073 -178.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.88 91.33 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.541 0.526 . . . . 0.0 111.554 -179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.7 mp0 -57.41 -47.13 82.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.901 0.382 . . . . 0.0 110.382 177.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.587 ' O ' HG13 ' A' ' 74' ' ' ILE . 36.1 m-70 -58.22 -41.63 84.52 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 177.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 43.4 mt-10 -59.57 -49.75 76.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.239 -178.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.4 p -63.99 -34.29 77.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.664 0.269 . . . . 0.0 111.259 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 69' ' ' GLU . 96.7 mt -61.39 -54.88 29.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.16 0.505 . . . . 0.0 111.006 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.587 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.7 mt -75.34 -21.53 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.799 -174.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 73.9 m -64.57 -37.3 87.07 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.23 -34.26 75.91 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.179 175.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.473 HD13 HG21 ' A' ' 55' ' ' ILE . 42.8 tp -64.81 -37.63 88.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.775 175.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 111.36 23.16 5.84 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.728 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.523 ' HB3' HG22 ' A' ' 74' ' ' ILE . 3.9 tpt180 -125.31 131.65 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -66.02 116.12 29.74 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 121.513 0.673 . . . . 0.0 110.331 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -83.38 -5.33 11.01 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 122.827 2.352 . . . . 0.0 113.167 -175.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.5 t -77.57 -0.13 25.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.404 178.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -77.81 -15.89 58.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.413 0.625 . . . . 0.0 109.713 176.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -102.52 128.04 49.32 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.002 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -84.83 -26.02 27.72 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.905 0.383 . . . . 0.0 111.09 -173.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.521 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 30.4 p30 -126.01 169.75 12.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.332 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.29 -18.24 59.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.589 0.233 . . . . 0.0 111.271 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.09 -49.27 68.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.894 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -62.94 -32.62 73.98 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.823 177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 86' ' ' ASN . 46.4 mtt-85 -65.35 -40.02 93.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.987 178.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 74.0 mt -62.83 -47.44 92.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.199 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.92 -39.72 78.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.621 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.98 -45.39 77.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.791 0.329 . . . . 0.0 110.39 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 90' ' ' ARG . 69.9 mt -66.21 -39.13 83.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.505 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 91' ' ' ILE . 56.3 mt -65.77 -30.05 70.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.833 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -80.56 -34.73 35.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.257 0.551 . . . . 0.0 110.32 179.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.66 -30.57 56.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.408 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.449 ' HA ' ' HD2' ' A' ' 101' ' ' LYS . 10.5 tt -69.44 -23.98 26.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 121.173 0.511 . . . . 0.0 109.794 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -72.22 -42.17 66.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.288 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -91.65 64.1 4.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.746 -178.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 98' ' ' ILE . 8.9 mtpm? -129.27 80.36 1.96 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.727 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -171.38 81.99 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.353 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -88.16 14.39 9.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.976 0.417 . . . . 0.0 111.157 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.8 mp -87.55 102.66 14.8 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -92.84 149.81 21.02 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.534 -171.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 16.9 m-70 -146.82 106.54 3.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.462 173.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -106.74 150.64 26.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.303 -173.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -67.67 114.41 6.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.479 176.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -74.21 134.72 42.73 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -59.98 -61.39 2.64 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.591 0.234 . . . . 0.0 110.945 -173.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.285 -0.864 . . . . 0.0 109.718 175.604 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.466 ' SD ' HG22 ' A' ' 26' ' ' THR . 13.3 tmm? . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -114.65 142.57 46.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.582 0.23 . . . . 0.0 111.018 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 24' ' ' SER . 26.0 p -129.6 142.78 50.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.842 0.353 . . . . 0.0 111.288 177.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.518 ' O ' ' HA ' ' A' ' 24' ' ' SER . . . -118.52 140.93 49.11 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 36.3 ttpt -122.07 123.29 41.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.146 0.498 . . . . 0.0 111.412 -175.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.525 ' HB2' ' HB3' ' A' ' 19' ' ' PHE . 3.4 tm? -73.86 125.28 27.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.182 176.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.551 HD13 HG13 ' A' ' 42' ' ' ILE . 43.4 pt -112.12 -15.06 10.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.601 -178.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.463 ' HB3' ' CB ' ' A' ' 40' ' ' TYR . 83.2 tttt -140.99 113.66 8.23 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.632 0.253 . . . . 0.0 110.811 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.68 -5.69 5.5 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.423 -0.894 . . . . 0.0 113.232 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? 73.6 -53.75 0.69 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.086 0.554 . . . . 0.0 110.784 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.496 HG22 ' HG2' ' A' ' 20' ' ' ARG . 1.4 p -147.02 142.2 27.22 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.378 178.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -152.91 140.34 19.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -107.76 129.36 55.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.936 -177.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -126.84 101.2 7.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.373 176.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . 0.515 ' SD ' HD21 ' A' ' 31' ' ' LEU . 65.9 mtt 56.05 32.98 21.03 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.666 176.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 105.35 -24.76 26.76 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.324 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.2 mm -75.09 118.6 21.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 20.5 m -100.05 105.45 17.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.178 0.513 . . . . 0.0 111.053 -176.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.525 ' HB3' ' HB2' ' A' ' 6' ' ' LEU . 95.2 m-85 -92.44 153.25 19.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.016 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HG2' HG22 ' A' ' 11' ' ' THR . 83.3 mtt85 -133.57 153.91 51.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.412 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -55.51 111.06 0.8 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.994 0.426 . . . . 0.0 111.218 176.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.8 6.37 67.52 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.636 178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 87.9 t -114.55 110.32 31.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.04 0.448 . . . . 0.0 111.139 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.532 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 24.8 p -86.7 114.94 23.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.686 174.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -110.51 159.27 17.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 177.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.466 HG22 ' SD ' ' A' ' 1' ' ' MET . 12.4 p -67.45 135.23 52.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.949 0.404 . . . . 0.0 112.022 -175.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 31.4 m -129.76 144.08 51.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.188 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.555 ' HD2' HD12 ' A' ' 31' ' ' LEU . 24.9 Cg_exo -66.21 167.89 17.23 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 123.24 2.626 . . . . 0.0 112.211 174.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -55.66 -40.28 72.05 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.421 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -75.57 -34.15 60.66 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.227 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.555 HD12 ' HD2' ' A' ' 28' ' ' PRO . 34.9 mt -75.99 -25.6 55.94 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.036 -179.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.48 -42.88 97.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.962 0.41 . . . . 0.0 110.087 176.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -77.96 -38.06 46.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.53 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -57.5 -43.5 84.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HB2' HD21 ' A' ' 43' ' ' LEU . 92.3 mt -84.72 -20.22 31.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.982 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -62.3 -36.6 82.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.357 0.598 . . . . 0.0 109.978 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -92.23 24.85 3.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.43 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -116.8 121.77 32.41 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.847 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.62 -32.63 93.56 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.274 2.649 . . . . 0.0 114.238 -174.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.463 ' CB ' ' HB3' ' A' ' 8' ' ' LYS . 6.1 p90 -99.24 23.27 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -131.16 120.34 23.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 111.453 175.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.551 HG13 HD13 ' A' ' 7' ' ' ILE . 71.4 mt -106.21 111.43 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.4 mp -91.8 169.14 10.94 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 49.8 m -152.67 128.74 10.39 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.89 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -89.1 135.87 33.33 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 0.0 110.271 177.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -101.52 -174.9 2.71 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.572 178.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.93 157.1 35.76 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.067 0.46 . . . . 0.0 110.71 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.431 HD22 ' C ' ' A' ' 48' ' ' ASN . 0.2 OUTLIER -79.5 -41.51 27.24 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.9 m120 64.29 -176.92 0.16 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.652 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -98.95 164.49 12.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 64.89 24.43 12.73 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.117 0.484 . . . . 0.0 110.402 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -66.77 -37.51 84.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.732 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -126.97 91.89 45.8 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.042 169.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.534 ' O ' HG23 ' A' ' 73' ' ' ILE . 7.0 Cg_exo -72.74 105.01 1.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 123.099 2.533 . . . . 0.0 112.182 -176.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.554 HD12 HG23 ' A' ' 94' ' ' ILE . 11.0 tp 178.32 26.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 121.951 0.881 . . . . 0.0 109.763 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.482 ' HA ' HD11 ' A' ' 98' ' ' ILE . 25.2 p-10 -142.48 38.22 1.52 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.567 -170.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 75.2 m-85 -96.64 165.64 12.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.945 0.402 . . . . 0.0 111.482 -175.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.524 ' HB ' ' CB ' ' A' ' 61' ' ' GLU . 14.3 m -64.37 138.17 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.194 178.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -51.28 -54.1 29.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.12 0.485 . . . . 0.0 109.774 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 32.4 t -59.34 -34.43 72.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.731 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' MET . 34.6 tt0 -71.79 -42.13 67.48 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.055 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 57' ' ' TYR . 80.8 mt -65.37 -40.9 94.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.325 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HG3' HG12 ' A' ' 91' ' ' ILE . 98.7 mttt -68.22 -17.17 64.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.033 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -106.54 11.14 42.64 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.237 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 45.9 mtt -89.13 162.19 16.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.011 0.434 . . . . 0.0 111.528 -179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.739 ' HB3' ' HG2' ' A' ' 69' ' ' GLU . 45.6 t-20 -71.2 145.98 49.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.252 -0.886 . . . . 0.0 109.202 174.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 14.2 tmtt? -53.69 -39.35 65.08 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.603 177.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.99 -28.03 67.93 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.742 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.739 ' HG2' ' HB3' ' A' ' 66' ' ' ASN . 23.1 mm-40 -64.35 -50.16 68.82 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 74' ' ' ILE . 64.8 m-70 -55.45 -42.49 74.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.916 176.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.542 ' HA ' ' HG3' ' A' ' 81' ' ' PRO . 45.6 mt-10 -58.51 -51.56 69.34 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.388 0.43 . . . . 0.0 110.352 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m -55.03 -42.11 72.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.509 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.534 HG23 ' O ' ' A' ' 54' ' ' PRO . 88.2 mt -57.7 -60.32 2.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.509 178.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.707 HG12 ' O ' ' A' ' 70' ' ' HIS . 3.1 pt -76.24 -13.92 14.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -174.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 69.7 m -72.59 -45.22 60.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -74.39 -30.2 61.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.524 HD22 HD13 ' A' ' 55' ' ' ILE . 33.4 tp -67.63 -34.2 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.917 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.41 36.06 3.67 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.17 -177.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.555 ' HB3' ' HB ' ' A' ' 74' ' ' ILE . 30.7 tpt180 -115.55 -50.92 2.7 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.573 0.225 . . . . 0.0 110.523 177.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.6 t30 68.08 134.12 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.452 0 O-C-N 124.028 0.83 . . . . 0.0 111.16 -177.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.542 ' HG3' ' HA ' ' A' ' 71' ' ' GLU . 20.4 Cg_endo -81.05 61.98 8.39 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.457 2.105 . . . . 0.0 112.506 -178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.7 p -86.42 -17.81 33.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.549 -179.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -149.77 81.76 1.39 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.298 0.571 . . . . 0.0 110.607 175.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.439 ' CD2' ' HA ' ' A' ' 81' ' ' PRO . 85.3 m-85 -142.27 108.57 5.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.15 174.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -102.67 -28.07 12.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.084 -175.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.594 ' HB2' ' HG2' ' A' ' 89' ' ' GLU . 84.0 m-20 -107.11 152.69 23.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.757 -179.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.58 -37.65 73.97 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 173.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -55.16 -41.49 71.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.707 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.594 ' HG2' ' HB2' ' A' ' 86' ' ' ASN . 48.2 mm-40 -59.88 -45.42 92.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.171 177.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -62.53 -46.79 86.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.692 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 63' ' ' LYS . 1.9 mp -66.52 -40.38 86.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.421 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.15 -40.53 90.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.493 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -71.04 -37.3 72.55 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.851 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.554 HG23 HD12 ' A' ' 55' ' ' ILE . 64.1 mt -70.72 -37.95 71.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.552 179.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.467 HD13 HD12 ' A' ' 98' ' ' ILE . 3.9 mm? -71.98 -18.71 61.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.133 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -60.9 -43.73 98.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.767 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -69.95 -37.35 75.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.661 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.482 HD11 ' HA ' ' A' ' 56' ' ' ASN . 64.2 mt -64.34 -41.61 92.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.56 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -68.82 -37.08 78.97 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.606 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.2 -54.68 22.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.775 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.8 tttm -101.64 24.04 10.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 110.984 -173.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -102.8 -13.86 28.6 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.0 -178.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -82.96 91.17 7.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.629 0.728 . . . . 0.0 111.716 -176.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.5 mp -126.5 -89.01 0.56 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.07 174.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -88.56 -41.81 12.46 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.73 142.15 51.47 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 58.1 t60 60.23 47.29 9.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -174.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -56.96 137.79 55.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.078 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -76.25 3.4 10.88 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -171.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -171.53 128.73 0.67 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 38.6 p-80 . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.214 -179.461 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.0 mtp . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 121.191 0.52 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.418 ' O ' ' HA ' ' A' ' 26' ' ' THR . 56.0 m-85 -111.34 130.15 55.77 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 25' ' ' GLN . 14.3 p -113.59 123.08 49.12 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.956 0.408 . . . . 0.0 110.823 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.98 135.06 49.19 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.136 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 24' ' ' SER . 28.7 ttpp -126.53 122.78 36.11 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.42 -178.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.4 tm? -63.95 117.4 6.96 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.745 HG13 ' HG3' ' A' ' 8' ' ' LYS . 33.7 pt -106.12 -27.21 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.593 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.745 ' HG3' HG13 ' A' ' 7' ' ' ILE . 29.9 mtpp -117.36 100.58 7.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.334 -177.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.8 -120.92 1.82 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.567 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.486 ' HG3' ' H ' ' A' ' 11' ' ' THR . 20.8 pttp -176.21 -56.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -174.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.486 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 3.5 p -142.21 119.22 11.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.206 -178.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -154.51 124.2 6.61 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -108.55 135.92 49.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.998 0.428 . . . . 0.0 110.631 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.418 HG21 HD21 ' A' ' 35' ' ' LEU . 58.5 t -107.3 107.03 21.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.944 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 66.9 mtt 65.66 -75.25 0.05 Allowed 'General case' 0 N--CA 1.465 0.282 0 O-C-N 123.972 0.795 . . . . 0.0 111.334 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -138.76 -3.02 1.84 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.82 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.1 mp -101.15 115.32 42.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -91.05 112.14 23.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.155 -174.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.44 153.81 19.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.269 0.556 . . . . 0.0 111.322 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -131.79 150.98 51.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.427 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -57.91 111.65 1.23 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.769 0.319 . . . . 0.0 110.841 175.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.76 -8.66 43.35 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.543 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -104.3 119.39 53.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.809 0.338 . . . . 0.0 110.654 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.549 ' HB3' ' HB2' ' A' ' 5' ' ' LYS . 20.4 p -102.72 123.08 45.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.204 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 3' ' ' THR . 48.9 mt-30 -127.65 157.78 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.655 0.265 . . . . 0.0 111.134 -178.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 2' ' ' PHE . 0.8 OUTLIER -71.83 128.81 36.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.605 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.412 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 34.1 m -123.95 145.84 49.14 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.684 178.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.553 ' HD2' HD12 ' A' ' 31' ' ' LEU . 26.0 Cg_exo -63.5 156.89 53.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.711 2.274 . . . . 0.0 111.356 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -53.94 -36.07 62.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.53 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.45 -44.68 95.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.066 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.553 HD12 ' HD2' ' A' ' 28' ' ' PRO . 76.4 mt -78.26 -26.81 47.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.764 0.316 . . . . 0.0 110.613 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -57.63 -48.33 79.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.391 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -77.1 -30.76 55.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.041 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -61.31 -46.15 91.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.107 176.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.418 HD21 HG21 ' A' ' 14' ' ' VAL . 82.8 mt -77.97 -19.55 54.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.247 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -65.53 -28.08 68.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.31 0.576 . . . . 0.0 110.079 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -90.64 10.64 24.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.951 176.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 40' ' ' TYR . 46.0 m-80 -135.02 97.44 13.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.359 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -71.81 28.07 0.24 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.788 2.992 . . . . 0.0 114.904 -169.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 8' ' ' LYS . 7.7 p90 -112.37 9.65 19.81 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.484 -0.487 . . . . 0.0 111.044 175.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.416 ' CZ ' HD23 ' A' ' 6' ' ' LEU . 42.9 m-85 -123.64 140.99 52.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.342 171.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 5' ' ' LYS . 15.8 tt -97.18 126.66 49.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 171.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.01 103.98 13.63 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.623 -174.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.9 m -106.26 125.04 50.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.417 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -105.44 106.27 16.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.339 0.59 . . . . 0.0 109.639 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -101.16 105.36 16.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.016 -172.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.2 mt -119.7 102.21 8.44 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.313 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -151.01 113.91 4.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.979 -177.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 50' ' ' GLN . 37.7 m-80 59.66 -161.5 0.27 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.626 174.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.43 ' H ' ' HB3' ' A' ' 49' ' ' ASN . 48.5 mt-30 -145.02 -60.85 0.36 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.502 -172.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -80.41 32.78 0.29 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.529 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -90.76 -13.15 34.53 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.99 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -148.72 96.08 3.87 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.483 ' O ' HG22 ' A' ' 55' ' ' ILE . 98.3 Cg_endo -88.26 169.03 6.23 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 123.07 2.513 . . . . 0.0 113.121 -176.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.517 HD11 ' HG3' ' A' ' 97' ' ' GLN . 7.2 tp 52.61 25.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.433 1.093 . . . . 0.0 111.738 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -157.02 92.66 1.28 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.988 -175.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -142.77 159.95 41.26 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.537 HG22 ' H ' ' A' ' 60' ' ' SER . 3.2 m -67.98 145.03 54.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.055 174.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.426 ' HB2' HD11 ' A' ' 95' ' ' LEU . 2.4 tm-20 -56.54 -31.64 64.34 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 171.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 58' ' ' THR . 14.9 m -60.05 -38.75 83.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.456 172.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.26 -36.25 24.69 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.21 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.0 mt -72.76 -16.86 61.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.41 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.594 ' HD2' HD13 ' A' ' 91' ' ' ILE . 0.6 OUTLIER -63.45 -36.03 82.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.453 176.663 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.43 -135.23 5.2 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.068 -176.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 75.8 mtm 61.77 -166.88 0.21 Allowed 'General case' 0 C--O 1.234 0.243 0 C-N-CA 122.896 0.478 . . . . 0.0 110.124 -173.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -106.26 162.2 13.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.453 ' HE2' ' HB2' ' A' ' 67' ' ' LYS . 3.5 mppt? -69.63 -33.44 72.63 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 121.343 -0.143 . . . . 0.0 110.73 -177.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.37 -46.04 46.63 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.793 0.683 . . . . 0.0 112.394 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 73' ' ' ILE . 1.6 mp0 -57.63 -55.99 27.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 110.068 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.537 ' HA ' HD12 ' A' ' 73' ' ' ILE . 69.3 m-70 -55.58 -47.75 75.92 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.998 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.49 -50.97 70.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.424 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.4 m -56.93 -37.83 72.03 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.316 0.579 . . . . 0.0 110.825 -178.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.537 HD12 ' HA ' ' A' ' 70' ' ' HIS . 88.0 mt -60.8 -60.11 3.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.544 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.459 ' HB ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -70.18 -29.04 38.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.113 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.508 ' HA ' ' OD1' ' A' ' 80' ' ' ASN . 13.6 p -67.17 -32.78 74.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.839 0.352 . . . . 0.0 110.659 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -87.46 -18.05 30.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.878 0.37 . . . . 0.0 110.942 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.8 -37.75 67.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.045 175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 126.25 -13.71 7.02 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.208 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.459 ' O ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -113.93 80.35 1.37 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.206 0.527 . . . . 0.0 110.244 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.508 ' OD1' ' HA ' ' A' ' 75' ' ' SER . 77.2 m-20 -52.64 139.72 39.38 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.101 178.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' ' HB2' ' A' ' 84' ' ' PHE . 61.1 Cg_endo -75.3 51.19 2.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.976 2.451 . . . . 0.0 113.006 -178.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.6 m -71.13 -51.06 27.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.874 0.369 . . . . 0.0 110.504 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -100.37 -6.22 26.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.122 0.486 . . . . 0.0 110.429 178.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.461 ' HB2' ' HA ' ' A' ' 81' ' ' PRO . 97.2 m-85 -90.79 108.66 19.97 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -145.2 -39.21 0.25 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.137 -171.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.75 139.96 57.84 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.562 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' ARG . . . -52.55 -52.89 52.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -175.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -74.63 -25.5 59.27 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.691 -174.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -69.84 -39.84 76.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.438 0.637 . . . . 0.0 109.978 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 87' ' ' ALA . 12.1 ttm180 -54.48 -54.2 44.07 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.417 174.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.594 HD13 ' HD2' ' A' ' 63' ' ' LYS . 47.4 mt -61.67 -42.66 95.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.685 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.11 74.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.867 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -65.45 -48.17 73.62 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.865 -177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 66.8 mt -67.27 -34.91 72.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.511 -176.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' A' ' 59' ' ' GLU . 29.2 mt -65.7 -39.45 91.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.008 176.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -68.63 -17.34 64.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.199 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.517 ' HG3' HD11 ' A' ' 55' ' ' ILE . 29.8 mm-40 -73.43 -24.8 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 176.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -86.59 -47.19 16.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.348 -179.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -66.3 -46.85 75.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.395 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -87.2 91.53 8.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.094 0.473 . . . . 0.0 110.053 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -147.76 -11.42 0.39 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.894 -178.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 118.57 75.36 0.49 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.779 177.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -75.85 94.79 3.39 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 172.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.8 tp -117.09 107.76 14.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.341 -174.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 106' ' ' HIS . 26.3 mt-10 -127.47 -35.43 2.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.94 174.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 105' ' ' GLU . 31.8 m-70 -111.2 120.55 42.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.262 -165.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' HB2' ' OXT' ' A' ' 111' ' ' HIS . 12.8 p-80 -81.37 168.94 17.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.759 174.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -85.02 -51.75 6.45 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.689 0.281 . . . . 0.0 111.013 -175.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -158.66 -83.12 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -90.78 -36.25 14.37 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.44 ' OXT' ' HB2' ' A' ' 107' ' ' HIS . 69.3 m-70 . . . . . 0 C--O 1.245 0.822 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.589 167.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 N--CA 1.484 1.233 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -107.11 131.3 54.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.882 0.373 . . . . 0.0 110.221 177.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.401 ' CG2' ' HB3' ' A' ' 24' ' ' SER . 12.5 m -138.62 127.47 23.71 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.381 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.95 138.88 44.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.406 ' HD3' ' OG ' ' A' ' 24' ' ' SER . 34.9 ttpt -129.79 116.51 18.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 21' ' ' ALA . 3.2 tm? -65.9 124.96 23.91 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.728 HG13 ' HG3' ' A' ' 8' ' ' LYS . 18.7 pt -117.18 -38.31 2.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.369 . . . . 0.0 111.319 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.728 ' HG3' HG13 ' A' ' 7' ' ' ILE . 61.5 mtpt -100.67 90.66 4.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.058 0.456 . . . . 0.0 110.243 -177.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.43 -137.22 6.47 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.697 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 10' ' ' LYS . 46.0 mtpt -154.25 -55.62 0.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.1 m -149.88 131.86 15.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.058 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -143.21 123.68 13.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.1 -177.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -85.17 117.58 24.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.93 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 94.0 t -114.41 106.25 20.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 176.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.73 -91.37 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.845 -177.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -128.98 6.79 6.43 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.8 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.467 ' N ' HD12 ' A' ' 17' ' ' ILE . 4.0 mp -108.89 129.74 62.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.6 m -98.61 105.81 18.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.97 0.414 . . . . 0.0 110.878 -179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -87.49 143.51 27.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.487 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -133.9 144.22 48.74 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.288 178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 6' ' ' LEU . . . -50.02 119.32 3.5 Favored 'General case' 0 C--N 1.331 -0.23 0 O-C-N 123.628 0.58 . . . . 0.0 112.033 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 -4.67 63.48 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.591 -0.731 . . . . 0.0 113.266 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.3 t -106.74 114.15 45.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 117.112 0.456 . . . . 0.0 111.669 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.406 ' OG ' ' HD3' ' A' ' 5' ' ' LYS . 41.4 m -79.12 130.97 36.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.107 171.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -129.78 139.3 51.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.772 0.32 . . . . 0.0 110.76 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -72.62 108.61 5.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 m -109.37 154.68 42.09 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.175 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.531 ' HD2' HD12 ' A' ' 31' ' ' LEU . 18.2 Cg_exo -67.37 164.39 30.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.955 2.436 . . . . 0.0 111.866 174.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -58.01 -40.04 79.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.564 -176.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.47 -48.91 73.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.463 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD12 ' HD2' ' A' ' 28' ' ' PRO . 59.1 mt -67.47 -27.37 66.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.171 -176.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -58.9 -48.38 81.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.847 0.356 . . . . 0.0 110.137 175.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.39 -37.36 63.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.749 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 31' ' ' LEU . 80.5 t80 -55.82 -42.98 76.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.734 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.504 HD22 ' CE1' ' A' ' 41' ' ' PHE . 87.2 mt -85.75 -18.96 31.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.991 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -61.48 -30.86 70.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.347 0.594 . . . . 0.0 109.838 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -82.81 -0.52 48.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.745 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -121.23 114.43 31.98 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.897 0.379 . . . . 0.0 110.951 -178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -78.16 44.58 1.62 Allowed 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 123.149 2.566 . . . . 0.0 113.542 -173.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -105.16 -15.53 15.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 110.297 176.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.504 ' CE1' HD22 ' A' ' 35' ' ' LEU . 35.9 m-85 -123.08 153.45 39.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.402 -167.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.577 HG12 HD13 ' A' ' 7' ' ' ILE . 25.9 mm -101.57 108.61 23.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 162.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -90.02 118.64 29.72 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.278 0.561 . . . . 0.0 110.083 -177.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 m -100.87 116.29 32.39 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.211 -175.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -89.85 112.41 23.75 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -101.49 149.45 24.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.156 0.503 . . . . 0.0 111.052 -170.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 72.2 mt -73.96 131.92 41.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.638 -169.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -104.5 4.16 32.79 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 165.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -78.65 -12.5 60.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.007 -171.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' GLN . 14.5 pt20 -73.03 89.99 1.48 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.406 0.622 . . . . 0.0 110.879 -178.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -135.47 63.9 1.59 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.369 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.95 -27.93 61.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.344 177.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 57.84 84.62 0.2 Allowed Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.867 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.512 ' O ' HG22 ' A' ' 55' ' ' ILE . 84.6 Cg_endo -94.31 146.83 1.87 Allowed 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.948 2.432 . . . . 0.0 112.912 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.813 HG21 HD13 ' A' ' 77' ' ' LEU . 3.8 tp 59.41 23.75 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 115.305 -0.861 . . . . 0.0 113.049 169.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.4 p-10 -136.64 38.49 2.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.211 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.479 ' HB2' HD21 ' A' ' 62' ' ' LEU . 68.6 m-85 -94.92 155.94 16.55 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.569 -178.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.573 ' HB ' ' HG2' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -57.53 127.01 29.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.748 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.748 ' HB3' ' HG ' ' A' ' 95' ' ' LEU . 1.9 pp20? -62.79 -26.19 68.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.142 0.496 . . . . 0.0 110.289 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.2 p -71.59 -30.73 66.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.948 174.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.573 ' HG2' ' HB ' ' A' ' 58' ' ' THR . 30.3 mm-40 -79.49 -40.7 29.12 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.138 -0.625 . . . . 0.0 109.561 175.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD21 ' HB2' ' A' ' 57' ' ' TYR . 92.3 mt -62.96 -20.93 65.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.153 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.614 ' HD3' HD13 ' A' ' 91' ' ' ILE . 0.1 OUTLIER -64.69 -33.46 76.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.916 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.95 -24.04 13.9 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.536 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 24.1 mmt -53.89 138.51 36.18 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.919 0.39 . . . . 0.0 110.99 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -84.47 -174.79 5.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.298 0.57 . . . . 0.0 111.836 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 71' ' ' GLU . 63.2 tttm -59.34 -54.41 47.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.421 -178.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.59 84.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.795 -174.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 73' ' ' ILE . 49.1 mt-10 -63.99 -51.46 64.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.517 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.561 ' O ' HG13 ' A' ' 74' ' ' ILE . 26.7 m-70 -55.31 -43.11 74.56 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.095 175.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.575 ' HG2' ' HG2' ' A' ' 81' ' ' PRO . 46.0 mt-10 -60.17 -45.23 93.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.963 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -65.21 -45.04 86.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.744 0.307 . . . . 0.0 110.475 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 69' ' ' GLU . 97.8 mt -55.37 -56.54 11.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.993 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 70' ' ' HIS . 3.1 mt -75.02 -25.75 18.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.065 -172.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.9 m -71.56 -27.18 62.98 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.111 175.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -69.88 -33.25 71.97 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 171.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.813 HD13 HG21 ' A' ' 55' ' ' ILE . 42.3 tp -67.17 -37.64 84.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.182 173.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 123.03 22.4 2.4 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.877 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 -146.74 126.09 13.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 111.217 178.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 17.2 m120 -80.09 137.6 53.18 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.122 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.575 ' HG2' ' HG2' ' A' ' 71' ' ' GLU . 8.7 Cg_endo -84.39 48.68 2.52 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.599 2.199 . . . . 0.0 112.237 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 10.1 p -85.95 -36.08 20.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.656 175.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -66.3 -35.56 80.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.128 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -96.03 108.65 21.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.302 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -94.45 -26.41 16.49 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.993 0.425 . . . . 0.0 110.783 -174.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.507 ' HB3' ' CD ' ' A' ' 89' ' ' GLU . 3.7 t-20 -99.09 151.34 21.07 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.107 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.467 ' O ' HG13 ' A' ' 91' ' ' ILE . . . -65.36 -32.68 74.44 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -177.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -57.38 -55.63 32.31 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.589 0.233 . . . . 0.0 111.386 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.507 ' CD ' ' HB3' ' A' ' 86' ' ' ASN . 1.1 pm0 -60.5 -34.25 73.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.284 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.429 ' O ' HG13 ' A' ' 94' ' ' ILE . 97.5 mtt180 -64.6 -44.24 91.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.429 177.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.614 HD13 ' HD3' ' A' ' 63' ' ' LYS . 80.7 mt -66.05 -44.87 91.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.127 177.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.33 96.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.5 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 97' ' ' GLN . 49.2 t80 -64.4 -42.36 96.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.455 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 90' ' ' ARG . 62.6 mt -69.73 -40.79 79.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 0.0 110.134 177.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.748 ' HG ' ' HB3' ' A' ' 59' ' ' GLU . 0.5 OUTLIER -57.66 -46.1 84.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.813 -179.623 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -76.42 -3.84 39.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -174.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.673 ' HG3' HG12 ' A' ' 55' ' ' ILE . 76.3 mm-40 -80.17 -30.15 38.8 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 172.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 51.4 mt -74.72 -34.88 35.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.591 174.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.1 -42.33 60.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.779 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -104.73 71.82 1.0 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.393 0.616 . . . . 0.0 110.205 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -111.85 116.09 30.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.951 -178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.81 110.93 3.05 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.842 176.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -98.13 37.69 1.41 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.512 0.672 . . . . 0.0 109.544 177.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.543 HD13 ' HB3' ' A' ' 108' ' ' HIS . 57.9 mt -93.54 147.02 23.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.855 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.57 -64.16 1.35 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -174.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -102.86 71.23 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -172.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 41.0 m80 57.26 23.18 8.47 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.391 174.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.543 ' HB3' HD13 ' A' ' 104' ' ' LEU . 8.4 p80 59.01 157.84 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.791 1.236 . . . . 0.0 113.417 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 46.0 t60 -88.09 152.09 22.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.604 -178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -99.53 -80.66 0.47 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 . . . . . 0 C--O 1.242 0.672 0 CA-C-O 118.799 -0.619 . . . . 0.0 109.651 177.323 . . . . . . . . 0 0 . 1 stop_ save_